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Acta Crystallographica Section E: Structure Reports Online logoLink to Acta Crystallographica Section E: Structure Reports Online
. 2013 May 22;69(Pt 6):m339. doi: 10.1107/S1600536813013470

Bis[μ-1,3-bis­(di­phenyl­phosphan­yl)propane-κ2 P:P′]digold(I) tetra­chloridonickelate(II) diethyl ether monosolvate

Asako Igashira-Kamiyama a,*, Takuma Itai a, Yuka Arai a, Takumi Konno a
PMCID: PMC3684897  PMID: 23794999

Abstract

The title compound, [Au2(C27H26P2)2][NiCl4]·C4H10O, consists of a digold(I) complex cation, an [NiCl4]2− complex anion and a diethyl ether solvent mol­ecule. Two 1,3-bis­(di­phenyl­phosphan­yl)propane (dppp) ligands bridge two AuI atoms, forming a metallacycle in which each of the AuI atoms is coordinated in a slightly distorted linear environment by two P atoms. In the complex anion, the NiII atom is coordinated by four chloride ligands in a distorted tetra­hedral geometry. The complex cation and the complex anion form a cation–anion pair through two Au⋯Cl contacts of 3.040 (1) and 3.021 (2) Å. One of the phenyl groups of the dppp ligand is disordered over two positions with equal occupancies.

Related literature  

For closely related structures, see: Gruber & Jansen (2010); Brandys & Puddephatt (2001). For related studies, see: Igashira-Kamiyama et al. (2012); Lee et al. (2012); Lim et al. (2011); Hashimoto et al. (2010). For the starting material, see: Howard-Lock et al. (1986); Blondeau et al. (1967); Mirabelli et al. (1987). For a description of the Cambridge Structural Database, see: Allen (2002).graphic file with name e-69-0m339-scheme1.jpg

Experimental  

Crystal data  

  • [Au2(C27H26P2)2][NiCl4]·C4H10O

  • M r = 1493.40

  • Monoclinic, Inline graphic

  • a = 18.9290 (5) Å

  • b = 16.1945 (7) Å

  • c = 19.0895 (17) Å

  • β = 97.368 (7)°

  • V = 5803.5 (6) Å3

  • Z = 4

  • Mo Kα radiation

  • μ = 5.70 mm−1

  • T = 200 K

  • 0.28 × 0.05 × 0.03 mm

Data collection  

  • Rigaku R-AXIS VII diffractometer

  • Absorption correction: multi-scan (ABSCOR; Higashi, 1995) T min = 0.580, T max = 0.773

  • 45449 measured reflections

  • 13273 independent reflections

  • 10666 reflections with I > 2σ(I)

  • R int = 0.042

Refinement  

  • R[F 2 > 2σ(F 2)] = 0.048

  • wR(F 2) = 0.083

  • S = 1.14

  • 13273 reflections

  • 685 parameters

  • 78 restraints

  • H-atom parameters constrained

  • Δρmax = 1.16 e Å−3

  • Δρmin = −0.88 e Å−3

Data collection: PROCESS-AUTO (Rigaku, 2000); cell refinement: PROCESS-AUTO; data reduction: PROCESS-AUTO; program(s) used to solve structure: SHELXS97 (Sheldrick, 2008); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008); molecular graphics: Yadokari-XG 2009 (Kabuto et al., 2009); software used to prepare material for publication: Yadokari-XG 2009.

Supplementary Material

Crystal structure: contains datablock(s) I, global. DOI: 10.1107/S1600536813013470/gk2571sup1.cif

e-69-0m339-sup1.cif (55.5KB, cif)

Structure factors: contains datablock(s) I. DOI: 10.1107/S1600536813013470/gk2571Isup2.hkl

e-69-0m339-Isup2.hkl (648.8KB, hkl)

Additional supplementary materials: crystallographic information; 3D view; checkCIF report

Table 1. Selected bond lengths (Å).

Au1—P1 2.3109 (13)
Au1—P3 2.3129 (13)
Au2—P2 2.3013 (13)
Au2—P4 2.3050 (13)
Ni1—Cl4 2.2359 (15)
Ni1—Cl2 2.2548 (16)
Ni1—Cl1 2.2558 (15)
Ni1—Cl3 2.2780 (14)

Acknowledgments

This work was supported by a Grant-in Aid for Science Research (No. 23350026) from the Ministry of Education, Culture, Sports, Science and Technology of Japan.

supplementary crystallographic information

Comment

In recent years, diphosphine-bridged cyclic digold(I) complexes have attracted considerable attention because of their intriguing photophysical properties that originate from the presence of an aurophilic interaction between gold(I) ions. A typical example is [Au2(dppm)2]2+ (dppm = bis(diphenylphosphanyl)methane), which is easily prepared from dppm having a methylene linker between two P atoms, in combination with an AuI ion. Analogous digold(I) complexes having a longer linker between two P atoms, such as 1,2-bis(diphenylphosphanyl)ethane (dppe) and 1,3-bis(diphenylphosphanyl)propane (dppp), have also been prepared, but only a few of them have been structurally characterized to date (Allen, 2002).

Recently, we started to investigate the creation of diphosphine-bridged digold(I) metalloligands and their coordination behavior toward various metal ions, with the aim of the rational construction of heterometallic multinuclear and metallosupramolecular structures (Lee et al., 2012; Igashira-Kamiyama et al., 2012; Hashimoto et al., 2010). In the course of this study, we found the formation of a diphosphine-bridged digold(I) complex, [Au2(dppp)2]2+ (dppp = 1,3-bis(diphenylphosphanyl)propane), which is cocrystallized with [NiCl4]2– to give single-crystals of [Au2(dppp)2][NiCl4].Et2O (I). Here, we report the synthesis and crystal structure of (I).

Treatment of [Au2Cl2(dppp)] (Mirabelli et al., 1987) with 1 equiv of N,N'-ethylene-bis-D-penicillamine (Howard-Lock et al., 1986; Blondeau et al., 1967) in ethanol/water in the presence of KOH gave a white powder. When this powder was reacted with NiCl2.6H2O in ethanol, blue needle crystals of [Au2(dppp)2][NiCl4].Et2O (I) were obtained by the vapor diffusion of diethylether into the reaction solution.

Compound (I) crystallized in a centrosymmetric space group P21/n, which contains one digold(I) complex cation, one nickel(II) complex anion and one solvate diethylether molecule in the asymmetric unit. The complex cation has a cyclic digold(I) structure in [Au2(dppp)2]2+, in which two dppp ligands bridge two AuI atoms. Each AuI atom adopts a slightly distorted linear geometry (176.68 (5)°, 177.98 (5)°) coordinated by two P atoms from two different dppp ligands (Fig. 1). The Au–P bond distances (2.3013 (13)–2.3129 (13) Å) are within the range observed for [Au2(dppp)2]2[Mo8O26], [Au2(dppp)2]2[PMo8O26] and [Au2(dppp)2](CF3CO2)2 (Au–P = 2.271–2.324 Å) (Gruber et al., 2010; Brandys et al., 2001). In the complex-cation of (I), two AuI atoms and four P atoms are deviated from co-planarity, with the dihedral angle between two Au2P2 planes being 21.94 (2)°. This structural feature is different from those found in [Au2(dppp)2]2[Mo8O26], [Au2(dppp)2]2[PMo8O26] and [Au2(dppp)2](CF3CO2)2, in which all the AuI and P atoms in each complex-cation are located nearly on the same plane (Gruber et al., 2010; Brandys et al., 2001). The distance between two AuI atoms in [Au2(dppp)2]2+ is 5.5424 (4) Å, indicative of the absence of an aurophilic interaction. In (I), a nickel(II) complex-anion, [NiCl4]2–, which has a distorted tetrahedral geometry, coexists with [Au2(dppp)2]2+ to balance the total charge. Note that [Au2(dppp)2]2+ and [NiCl4]2– are connected to each other through two Au···Cl bonding interactions (3.040 (1) Å and 3.021 (2) Å), while any other significant intermolecular interactions do not exist in (I) (Fig. 2).

Experimental

To a white suspension containing 0.15 g (0.17 mmol) of [Au2Cl2(dppp)] in 300 ml of EtOH was added 0.056 g (0.17 mmol) of N,N'-ethylene-bis-D-penicillamine dissolved in 3 ml of a 0.1 M KOH aqueous solution. The mixture was stirred at room temperature for 3 h. The resulting colorless solution was evaporated to dryness, and then the residue was washed with H2O to give a white powder (0.15 g). When 2.5 mg (0.01 mmol) of NiCl2.6H2O was added to a suspension of this white powder (10 mg) in 1 ml of EtOH, followed by stirring at room temperature for 3 h, a clear red orange solution was obtained. Vapor diffusion of diethylether into the resulting red orange solution afforded a small amount of blue needle crystals of [Au2(dppp)2][NiCl4].Et2O.

Refinement

H atoms were placed at calculated positions [C–H = 0.99 (methylene) or 0.95 Å (phenyl)] and refined as riding with Uiso(H) = 1.2Ueq(C). One phenyl ring is disordered over two positions (C7–C12 and C13–C18) with site occupancies of 0.5. The FLAT and SIMU restraints were used to model the disordered phenyl ring.

Figures

Fig. 1.

Fig. 1.

A view of the molecular structure of the title compound with the atom-numbering scheme. H atoms are omitted for clarity.

Fig. 2.

Fig. 2.

Crystal packing of the title compound. H atoms are omitted for clarity.

Crystal data

[Au2(C27H26P2)2][NiCl4]·C4H10O F(000) = 2928
Mr = 1493.40 Dx = 1.709 Mg m3
Monoclinic, P21/n Mo Kα radiation, λ = 0.71075 Å
Hall symbol: -P 2yn Cell parameters from 2299 reflections
a = 18.9290 (5) Å θ = 4.1–27.6°
b = 16.1945 (7) Å µ = 5.70 mm1
c = 19.0895 (17) Å T = 200 K
β = 97.368 (7)° Needle, blue
V = 5803.5 (6) Å3 0.28 × 0.05 × 0.03 mm
Z = 4

Data collection

Rigaku R-AXIS VII diffractometer 13273 independent reflections
Radiation source: fine-focus sealed tube 10666 reflections with I > 2σ(I)
Graphite monochromator Rint = 0.042
Detector resolution: 10.000 pixels mm-1 θmax = 27.5°, θmin = 3.0°
ω scans h = −22→24
Absorption correction: multi-scan (ABSCOR; Higashi, 1995) k = −20→21
Tmin = 0.580, Tmax = 0.773 l = −24→24
45449 measured reflections

Refinement

Refinement on F2 Primary atom site location: structure-invariant direct methods
Least-squares matrix: full Secondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.048 Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.083 H-atom parameters constrained
S = 1.14 w = 1/[σ2(Fo2) + (0.0332P)2 + 5.0632P] where P = (Fo2 + 2Fc2)/3
13273 reflections (Δ/σ)max = 0.001
685 parameters Δρmax = 1.16 e Å3
78 restraints Δρmin = −0.88 e Å3

Special details

Geometry. All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of e.s.d.'s in distances, angles and torsion angles; correlations between e.s.d.'s in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell e.s.d.'s is used for estimating e.s.d.'s involving l.s. planes.
Refinement. Refinement of F2 against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F2, conventional R-factors R are based on F, with F set to zero for negative F2. The threshold expression of F2 > σ(F2) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F2 are statistically about twice as large as those based on F, and R-factors based on ALL data will be even larger.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2)

x y z Uiso*/Ueq Occ. (<1)
Au1 0.779915 (10) 0.834674 (12) 0.074536 (10) 0.03063 (6)
Au2 0.549659 (10) 0.900739 (12) 0.218117 (10) 0.02907 (6)
P1 0.73666 (7) 0.70192 (8) 0.05633 (7) 0.0304 (3)
P2 0.53747 (7) 0.76109 (8) 0.23538 (7) 0.0285 (3)
P3 0.81787 (6) 0.96902 (8) 0.09657 (7) 0.0271 (3)
P4 0.56077 (6) 1.03989 (8) 0.19661 (7) 0.0266 (3)
C1 0.7040 (3) 0.6692 (3) 0.1377 (3) 0.0324 (12)
H1 0.6837 0.6129 0.1313 0.039*
H2 0.7443 0.6670 0.1762 0.039*
C2 0.6472 (2) 0.7282 (3) 0.1583 (3) 0.0306 (11)
H3 0.6057 0.7270 0.1210 0.037*
H4 0.6666 0.7850 0.1605 0.037*
C3 0.6218 (2) 0.7075 (3) 0.2294 (2) 0.0296 (11)
H5 0.6580 0.7251 0.2686 0.036*
H6 0.6149 0.6471 0.2333 0.036*
C4 0.7729 (2) 1.0247 (3) 0.1619 (3) 0.0289 (11)
H7 0.7878 1.0008 0.2092 0.035*
H8 0.7881 1.0832 0.1630 0.035*
C5 0.6909 (2) 1.0206 (3) 0.1457 (3) 0.0348 (12)
H9 0.6760 1.0424 0.0976 0.042*
H10 0.6754 0.9622 0.1466 0.042*
C6 0.6541 (2) 1.0700 (3) 0.1987 (3) 0.0304 (11)
H11 0.6568 1.1296 0.1877 0.036*
H12 0.6794 1.0610 0.2468 0.036*
C7 0.802 (2) 0.623 (3) 0.0354 (17) 0.055 (4) 0.50
C8 0.7861 (11) 0.5432 (14) 0.0384 (9) 0.064 (4) 0.50
H13 0.7424 0.5264 0.0537 0.077* 0.50
C9 0.8353 (12) 0.4825 (17) 0.0181 (13) 0.070 (4) 0.50
H14 0.8255 0.4253 0.0218 0.085* 0.50
C10 0.8946 (13) 0.5076 (15) −0.0057 (11) 0.075 (4) 0.50
H15 0.9253 0.4681 −0.0228 0.090* 0.50
C11 0.9112 (9) 0.5852 (10) −0.0060 (10) 0.078 (3) 0.50
H16 0.9559 0.6015 −0.0191 0.094* 0.50
C12 0.8637 (8) 0.6454 (10) 0.0129 (9) 0.067 (3) 0.50
H17 0.8751 0.7023 0.0097 0.081* 0.50
C13 0.7966 (16) 0.622 (3) 0.0378 (12) 0.030 (3) 0.50
C14 0.7708 (9) 0.5416 (12) 0.0162 (8) 0.042 (3) 0.50
H18 0.7210 0.5317 0.0094 0.051* 0.50
C15 0.8156 (8) 0.4794 (15) 0.0055 (11) 0.049 (3) 0.50
H19 0.7983 0.4265 −0.0099 0.059* 0.50
C16 0.8907 (12) 0.4968 (14) 0.0186 (9) 0.056 (3) 0.50
H20 0.9236 0.4548 0.0101 0.067* 0.50
C17 0.9153 (7) 0.5694 (9) 0.0421 (8) 0.056 (3) 0.50
H21 0.9652 0.5785 0.0516 0.068* 0.50
C18 0.8683 (7) 0.6319 (9) 0.0526 (7) 0.045 (3) 0.50
H22 0.8866 0.6833 0.0708 0.054* 0.50
C19 0.6622 (3) 0.6947 (3) −0.0140 (3) 0.0304 (11)
C20 0.6632 (3) 0.7447 (3) −0.0737 (3) 0.0430 (14)
H23 0.7014 0.7821 −0.0764 0.052*
C21 0.6076 (3) 0.7395 (4) −0.1294 (3) 0.0500 (16)
H24 0.6087 0.7727 −0.1703 0.060*
C22 0.5512 (3) 0.6863 (4) −0.1253 (3) 0.0525 (17)
H25 0.5130 0.6839 −0.1627 0.063*
C23 0.5506 (3) 0.6369 (3) −0.0668 (3) 0.0469 (15)
H26 0.5123 0.5996 −0.0647 0.056*
C24 0.6050 (3) 0.6407 (3) −0.0109 (3) 0.0404 (13)
H27 0.6034 0.6067 0.0294 0.048*
C25 0.5129 (3) 0.7377 (3) 0.3220 (3) 0.0354 (12)
C26 0.4619 (3) 0.6787 (3) 0.3322 (3) 0.0456 (15)
H28 0.4399 0.6472 0.2934 0.055*
C27 0.4431 (4) 0.6658 (4) 0.3999 (4) 0.0574 (18)
H29 0.4071 0.6269 0.4069 0.069*
C28 0.4769 (4) 0.7097 (4) 0.4565 (4) 0.072 (2)
H30 0.4649 0.7002 0.5026 0.086*
C29 0.5281 (5) 0.7671 (4) 0.4462 (3) 0.078 (2)
H31 0.5512 0.7973 0.4852 0.093*
C30 0.5462 (4) 0.7811 (4) 0.3794 (3) 0.0577 (18)
H32 0.5816 0.8209 0.3728 0.069*
C31 0.4727 (2) 0.7128 (3) 0.1696 (3) 0.0279 (11)
C32 0.4813 (3) 0.6337 (3) 0.1438 (3) 0.0432 (14)
H33 0.5202 0.6007 0.1638 0.052*
C33 0.4338 (3) 0.6028 (4) 0.0894 (3) 0.0498 (15)
H34 0.4401 0.5483 0.0728 0.060*
C34 0.3779 (3) 0.6490 (4) 0.0588 (3) 0.0518 (16)
H35 0.3464 0.6274 0.0204 0.062*
C35 0.3675 (3) 0.7272 (4) 0.0841 (3) 0.0485 (15)
H36 0.3277 0.7591 0.0644 0.058*
C36 0.4150 (3) 0.7590 (3) 0.1381 (3) 0.0366 (12)
H37 0.4083 0.8135 0.1542 0.044*
C37 0.8062 (2) 1.0336 (3) 0.0176 (3) 0.0303 (11)
C38 0.7747 (3) 1.0013 (4) −0.0457 (3) 0.0444 (14)
H38 0.7611 0.9448 −0.0481 0.053*
C39 0.7627 (3) 1.0501 (5) −0.1058 (3) 0.0565 (18)
H39 0.7405 1.0277 −0.1491 0.068*
C40 0.7836 (3) 1.1317 (5) −0.1014 (4) 0.0618 (19)
H40 0.7763 1.1655 −0.1423 0.074*
C41 0.8145 (3) 1.1645 (4) −0.0391 (4) 0.0562 (18)
H41 0.8276 1.2211 −0.0367 0.067*
C42 0.8268 (3) 1.1151 (3) 0.0208 (3) 0.0422 (14)
H42 0.8495 1.1377 0.0639 0.051*
C43 0.9125 (2) 0.9708 (3) 0.1293 (3) 0.0269 (11)
C44 0.9617 (3) 0.9585 (3) 0.0813 (3) 0.0345 (12)
H43 0.9457 0.9566 0.0320 0.041*
C45 1.0339 (3) 0.9489 (3) 0.1052 (3) 0.0396 (13)
H44 1.0666 0.9401 0.0721 0.048*
C46 1.0583 (3) 0.9520 (3) 0.1762 (3) 0.0377 (13)
H45 1.1076 0.9455 0.1920 0.045*
C47 1.0108 (3) 0.9648 (3) 0.2241 (3) 0.0363 (12)
H46 1.0276 0.9679 0.2731 0.044*
C48 0.9377 (3) 0.9733 (3) 0.2010 (3) 0.0318 (11)
H47 0.9052 0.9809 0.2345 0.038*
C49 0.5141 (2) 1.0717 (3) 0.1118 (2) 0.0265 (10)
C50 0.5378 (3) 1.1376 (3) 0.0733 (3) 0.0341 (12)
H48 0.5804 1.1664 0.0900 0.041*
C51 0.4972 (3) 1.1601 (3) 0.0095 (3) 0.0434 (14)
H49 0.5123 1.2050 −0.0170 0.052*
C52 0.4360 (3) 1.1183 (4) −0.0153 (3) 0.0420 (14)
H50 0.4093 1.1340 −0.0588 0.050*
C53 0.4130 (3) 1.0534 (3) 0.0231 (3) 0.0409 (14)
H51 0.3702 1.0251 0.0064 0.049*
C54 0.4522 (3) 1.0298 (3) 0.0853 (3) 0.0343 (12)
H52 0.4368 0.9842 0.1108 0.041*
C55 0.5201 (3) 1.1036 (3) 0.2596 (3) 0.0320 (12)
C56 0.5434 (3) 1.1835 (3) 0.2746 (3) 0.0463 (15)
H53 0.5833 1.2046 0.2549 0.056*
C57 0.5084 (4) 1.2322 (4) 0.3184 (3) 0.0583 (18)
H54 0.5246 1.2869 0.3289 0.070*
C58 0.4510 (4) 1.2029 (5) 0.3467 (4) 0.067 (2)
H55 0.4272 1.2376 0.3763 0.081*
C59 0.4271 (4) 1.1241 (5) 0.3329 (4) 0.069 (2)
H56 0.3869 1.1040 0.3528 0.083*
C60 0.4624 (3) 1.0732 (4) 0.2892 (3) 0.0530 (16)
H57 0.4468 1.0181 0.2800 0.064*
Ni1 0.79494 (3) 0.85982 (4) 0.34081 (3) 0.03311 (16)
Cl1 0.81798 (9) 0.81747 (9) 0.23347 (7) 0.0496 (4)
Cl2 0.68553 (8) 0.91672 (11) 0.32021 (9) 0.0624 (5)
Cl3 0.87604 (7) 0.96027 (8) 0.37596 (7) 0.0377 (3)
Cl4 0.77899 (8) 0.74535 (9) 0.40236 (8) 0.0508 (4)
O1 0.2306 (3) 0.4928 (4) 0.2151 (3) 0.0986 (18)
C61 0.2757 (5) 0.5546 (8) 0.2001 (6) 0.125 (4)
H58 0.2643 0.5702 0.1498 0.150*
H59 0.3252 0.5337 0.2072 0.150*
C62 0.2710 (6) 0.6288 (8) 0.2443 (8) 0.171 (6)
H60 0.3041 0.6709 0.2312 0.257*
H61 0.2835 0.6142 0.2942 0.257*
H62 0.2223 0.6505 0.2369 0.257*
C63 0.2334 (7) 0.4189 (7) 0.1756 (5) 0.125 (4)
H63 0.2798 0.3912 0.1889 0.151*
H64 0.2286 0.4319 0.1246 0.151*
C64 0.1743 (8) 0.3632 (7) 0.1905 (7) 0.174 (6)
H65 0.1764 0.3118 0.1637 0.260*
H66 0.1285 0.3905 0.1764 0.260*
H67 0.1793 0.3507 0.2411 0.260*

Atomic displacement parameters (Å2)

U11 U22 U33 U12 U13 U23
Au1 0.02931 (11) 0.03070 (12) 0.03187 (11) −0.00375 (8) 0.00394 (8) −0.00447 (8)
Au2 0.03258 (11) 0.02486 (11) 0.02932 (11) 0.00187 (8) 0.00220 (8) 0.00207 (8)
P1 0.0302 (7) 0.0293 (7) 0.0310 (7) −0.0001 (6) 0.0014 (6) −0.0036 (6)
P2 0.0322 (7) 0.0262 (7) 0.0271 (7) 0.0005 (6) 0.0038 (5) 0.0034 (5)
P3 0.0232 (7) 0.0300 (7) 0.0283 (7) −0.0020 (5) 0.0043 (5) −0.0013 (5)
P4 0.0250 (7) 0.0248 (7) 0.0297 (7) 0.0018 (5) 0.0029 (5) −0.0008 (5)
C1 0.038 (3) 0.023 (3) 0.034 (3) 0.003 (2) −0.004 (2) 0.002 (2)
C2 0.026 (3) 0.029 (3) 0.036 (3) 0.000 (2) 0.003 (2) 0.002 (2)
C3 0.031 (3) 0.026 (3) 0.031 (3) 0.004 (2) 0.000 (2) 0.004 (2)
C4 0.029 (3) 0.028 (3) 0.029 (3) −0.005 (2) 0.004 (2) −0.003 (2)
C5 0.027 (3) 0.038 (3) 0.039 (3) −0.001 (2) 0.002 (2) −0.009 (2)
C6 0.032 (3) 0.027 (3) 0.031 (3) 0.007 (2) 0.000 (2) −0.007 (2)
C7 0.046 (8) 0.048 (7) 0.077 (8) 0.005 (6) 0.026 (6) −0.011 (7)
C8 0.057 (8) 0.055 (7) 0.084 (8) 0.013 (6) 0.019 (6) −0.008 (7)
C9 0.063 (8) 0.054 (7) 0.098 (9) 0.015 (7) 0.020 (7) −0.007 (7)
C10 0.065 (7) 0.061 (7) 0.104 (9) 0.019 (6) 0.026 (7) −0.011 (7)
C11 0.063 (7) 0.064 (7) 0.111 (8) 0.004 (6) 0.023 (7) −0.009 (7)
C12 0.051 (7) 0.055 (7) 0.100 (8) −0.002 (5) 0.026 (6) −0.012 (6)
C13 0.023 (6) 0.036 (6) 0.030 (5) 0.003 (5) −0.005 (5) −0.006 (5)
C14 0.030 (6) 0.042 (6) 0.053 (6) 0.001 (5) −0.001 (5) −0.010 (5)
C15 0.035 (6) 0.044 (6) 0.067 (7) 0.006 (5) 0.005 (5) −0.003 (5)
C16 0.040 (6) 0.057 (7) 0.072 (7) 0.014 (5) 0.012 (6) 0.005 (6)
C17 0.034 (5) 0.067 (6) 0.068 (6) 0.009 (5) 0.006 (5) −0.002 (5)
C18 0.030 (5) 0.052 (6) 0.052 (5) 0.010 (4) −0.003 (5) −0.008 (5)
C19 0.030 (3) 0.030 (3) 0.029 (3) 0.007 (2) −0.003 (2) −0.005 (2)
C20 0.047 (3) 0.040 (3) 0.043 (3) 0.002 (3) 0.008 (3) −0.002 (3)
C21 0.064 (4) 0.056 (4) 0.028 (3) 0.014 (3) −0.003 (3) 0.001 (3)
C22 0.058 (4) 0.050 (4) 0.043 (4) 0.017 (3) −0.021 (3) −0.015 (3)
C23 0.039 (3) 0.034 (3) 0.063 (4) −0.003 (3) −0.010 (3) −0.013 (3)
C24 0.045 (3) 0.026 (3) 0.047 (3) −0.005 (2) −0.007 (3) −0.002 (2)
C25 0.048 (3) 0.029 (3) 0.031 (3) 0.007 (2) 0.010 (2) 0.007 (2)
C26 0.054 (4) 0.042 (4) 0.043 (3) −0.001 (3) 0.015 (3) 0.004 (3)
C27 0.078 (5) 0.043 (4) 0.059 (4) −0.001 (3) 0.036 (4) 0.010 (3)
C28 0.129 (7) 0.053 (4) 0.040 (4) 0.007 (5) 0.038 (4) 0.005 (3)
C29 0.138 (7) 0.066 (5) 0.029 (4) −0.020 (5) 0.009 (4) −0.004 (3)
C30 0.087 (5) 0.051 (4) 0.035 (3) −0.019 (4) 0.006 (3) 0.003 (3)
C31 0.026 (3) 0.027 (3) 0.032 (3) −0.003 (2) 0.009 (2) 0.002 (2)
C32 0.046 (3) 0.032 (3) 0.049 (4) −0.002 (3) −0.005 (3) 0.002 (3)
C33 0.052 (4) 0.035 (3) 0.061 (4) −0.005 (3) 0.003 (3) −0.010 (3)
C34 0.048 (4) 0.061 (4) 0.043 (4) −0.009 (3) −0.004 (3) −0.006 (3)
C35 0.034 (3) 0.062 (4) 0.048 (4) 0.009 (3) −0.003 (3) −0.002 (3)
C36 0.035 (3) 0.038 (3) 0.037 (3) 0.004 (2) 0.002 (2) −0.004 (2)
C37 0.023 (3) 0.037 (3) 0.033 (3) 0.006 (2) 0.011 (2) 0.005 (2)
C38 0.034 (3) 0.064 (4) 0.034 (3) 0.003 (3) 0.002 (2) 0.009 (3)
C39 0.043 (4) 0.092 (6) 0.035 (3) 0.016 (4) 0.006 (3) 0.010 (3)
C40 0.058 (4) 0.077 (5) 0.053 (4) 0.034 (4) 0.018 (3) 0.030 (4)
C41 0.063 (4) 0.049 (4) 0.062 (4) 0.019 (3) 0.028 (4) 0.020 (3)
C42 0.043 (3) 0.042 (4) 0.045 (3) 0.013 (3) 0.019 (3) 0.004 (3)
C43 0.028 (3) 0.019 (3) 0.033 (3) 0.001 (2) 0.005 (2) −0.002 (2)
C44 0.035 (3) 0.040 (3) 0.029 (3) 0.004 (2) 0.005 (2) 0.001 (2)
C45 0.030 (3) 0.044 (3) 0.047 (3) 0.005 (2) 0.016 (3) 0.008 (3)
C46 0.023 (3) 0.038 (3) 0.051 (4) 0.000 (2) 0.003 (2) 0.004 (3)
C47 0.035 (3) 0.039 (3) 0.034 (3) −0.004 (2) 0.002 (2) −0.001 (2)
C48 0.030 (3) 0.030 (3) 0.037 (3) 0.000 (2) 0.010 (2) 0.000 (2)
C49 0.025 (3) 0.027 (3) 0.029 (3) 0.006 (2) 0.008 (2) −0.001 (2)
C50 0.035 (3) 0.027 (3) 0.042 (3) 0.003 (2) 0.011 (2) 0.002 (2)
C51 0.056 (4) 0.039 (3) 0.036 (3) 0.014 (3) 0.012 (3) 0.012 (3)
C52 0.041 (3) 0.052 (4) 0.032 (3) 0.021 (3) 0.001 (3) −0.002 (3)
C53 0.039 (3) 0.046 (4) 0.036 (3) 0.001 (3) −0.003 (3) −0.006 (3)
C54 0.033 (3) 0.031 (3) 0.039 (3) 0.002 (2) 0.003 (2) 0.003 (2)
C55 0.034 (3) 0.035 (3) 0.028 (3) 0.008 (2) 0.005 (2) −0.002 (2)
C56 0.062 (4) 0.037 (4) 0.041 (3) 0.009 (3) 0.013 (3) 0.000 (3)
C57 0.087 (5) 0.043 (4) 0.048 (4) 0.014 (4) 0.017 (4) −0.008 (3)
C58 0.089 (6) 0.067 (5) 0.051 (4) 0.036 (4) 0.027 (4) −0.002 (4)
C59 0.066 (5) 0.084 (6) 0.065 (5) 0.013 (4) 0.037 (4) 0.002 (4)
C60 0.051 (4) 0.051 (4) 0.063 (4) −0.003 (3) 0.031 (3) −0.005 (3)
Ni1 0.0343 (4) 0.0337 (4) 0.0296 (4) −0.0045 (3) −0.0027 (3) 0.0019 (3)
Cl1 0.0703 (10) 0.0470 (9) 0.0309 (7) −0.0074 (7) 0.0042 (7) −0.0045 (6)
Cl2 0.0373 (8) 0.0790 (12) 0.0660 (11) 0.0071 (8) −0.0121 (7) 0.0174 (9)
Cl3 0.0343 (7) 0.0340 (7) 0.0437 (8) −0.0041 (6) 0.0011 (6) −0.0060 (6)
Cl4 0.0627 (10) 0.0424 (9) 0.0474 (9) −0.0060 (7) 0.0077 (7) 0.0110 (7)
O1 0.106 (5) 0.114 (5) 0.080 (4) −0.022 (4) 0.031 (4) −0.001 (4)
C61 0.063 (6) 0.172 (11) 0.138 (10) −0.017 (7) 0.002 (6) 0.068 (9)
C62 0.128 (10) 0.147 (11) 0.220 (16) −0.082 (9) −0.050 (10) 0.032 (11)
C63 0.191 (12) 0.114 (9) 0.075 (7) 0.044 (8) 0.029 (7) −0.010 (6)
C64 0.281 (18) 0.105 (9) 0.134 (11) −0.074 (11) 0.023 (11) −0.022 (8)

Geometric parameters (Å, º)

Au1—P1 2.3109 (13) C29—H31 0.9500
Au1—P3 2.3129 (13) C30—H32 0.9500
Au2—P2 2.3013 (13) C31—C32 1.389 (7)
Au2—P4 2.3050 (13) C31—C36 1.395 (7)
P1—C13 1.78 (4) C32—C33 1.378 (7)
P1—C19 1.820 (5) C32—H33 0.9500
P1—C1 1.822 (5) C33—C34 1.364 (8)
P1—C7 1.87 (5) C33—H34 0.9500
P2—C25 1.815 (5) C34—C35 1.378 (8)
P2—C31 1.816 (5) C34—H35 0.9500
P2—C3 1.833 (5) C35—C36 1.377 (7)
P3—C43 1.820 (5) C35—H36 0.9500
P3—C37 1.824 (5) C36—H37 0.9500
P3—C4 1.834 (5) C37—C42 1.377 (7)
P4—C49 1.816 (5) C37—C38 1.379 (7)
P4—C6 1.828 (5) C38—C39 1.388 (8)
P4—C55 1.829 (5) C38—H38 0.9500
C1—C2 1.528 (7) C39—C40 1.378 (9)
C1—H1 0.9900 C39—H39 0.9500
C1—H2 0.9900 C40—C41 1.363 (9)
C2—C3 1.535 (6) C40—H40 0.9500
C2—H3 0.9900 C41—C42 1.390 (8)
C2—H4 0.9900 C41—H41 0.9500
C3—H5 0.9900 C42—H42 0.9500
C3—H6 0.9900 C43—C48 1.391 (7)
C4—C5 1.545 (6) C43—C44 1.402 (7)
C4—H7 0.9900 C44—C45 1.393 (7)
C4—H8 0.9900 C44—H43 0.9500
C5—C6 1.526 (6) C45—C46 1.375 (7)
C5—H9 0.9900 C45—H44 0.9500
C5—H10 0.9900 C46—C47 1.379 (7)
C6—H11 0.9900 C46—H45 0.9500
C6—H12 0.9900 C47—C48 1.405 (7)
C7—C8 1.33 (5) C47—H46 0.9500
C7—C12 1.34 (4) C48—H47 0.9500
C8—C9 1.44 (3) C49—C54 1.392 (7)
C8—H13 0.9500 C49—C50 1.403 (7)
C9—C10 1.33 (3) C50—C51 1.402 (7)
C9—H14 0.9500 C50—H48 0.9500
C10—C11 1.30 (3) C51—C52 1.373 (8)
C10—H15 0.9500 C51—H49 0.9500
C11—C12 1.40 (2) C52—C53 1.383 (8)
C11—H16 0.9500 C52—H50 0.9500
C12—H17 0.9500 C53—C54 1.372 (7)
C13—C18 1.36 (3) C53—H51 0.9500
C13—C14 1.44 (4) C54—H52 0.9500
C14—C15 1.35 (2) C55—C60 1.383 (7)
C14—H18 0.9500 C55—C56 1.384 (7)
C15—C16 1.44 (3) C56—C57 1.379 (8)
C15—H19 0.9500 C56—H53 0.9500
C16—C17 1.32 (2) C57—C58 1.359 (9)
C16—H20 0.9500 C57—H54 0.9500
C17—C18 1.380 (17) C58—C59 1.368 (10)
C17—H21 0.9500 C58—H55 0.9500
C18—H22 0.9500 C59—C60 1.401 (8)
C19—C24 1.400 (7) C59—H56 0.9500
C19—C20 1.401 (7) C60—H57 0.9500
C20—C21 1.399 (7) Ni1—Cl4 2.2359 (15)
C20—H23 0.9500 Ni1—Cl2 2.2548 (16)
C21—C22 1.382 (8) Ni1—Cl1 2.2558 (15)
C21—H24 0.9500 Ni1—Cl3 2.2780 (14)
C22—C23 1.375 (8) O1—C61 1.370 (10)
C22—H25 0.9500 O1—C63 1.418 (10)
C23—C24 1.386 (7) C61—C62 1.477 (15)
C23—H26 0.9500 C61—H58 0.9900
C24—H27 0.9500 C61—H59 0.9900
C25—C30 1.384 (7) C62—H60 0.9800
C25—C26 1.390 (7) C62—H61 0.9800
C26—C27 1.399 (8) C62—H62 0.9800
C26—H28 0.9500 C63—C64 1.492 (14)
C27—C28 1.380 (9) C63—H63 0.9900
C27—H29 0.9500 C63—H64 0.9900
C28—C29 1.375 (9) C64—H65 0.9800
C28—H30 0.9500 C64—H66 0.9800
C29—C30 1.379 (8) C64—H67 0.9800
P1—Au1—P3 176.68 (5) C29—C28—H30 120.0
P2—Au2—P4 177.98 (5) C27—C28—H30 120.0
C13—P1—C19 105.0 (8) C28—C29—C30 120.4 (6)
C13—P1—C1 104.7 (10) C28—C29—H31 119.8
C19—P1—C1 107.1 (2) C30—C29—H31 119.8
C19—P1—C7 105.8 (11) C29—C30—C25 120.4 (6)
C1—P1—C7 106.9 (12) C29—C30—H32 119.8
C13—P1—Au1 118.7 (11) C25—C30—H32 119.8
C19—P1—Au1 113.35 (17) C32—C31—C36 117.5 (5)
C1—P1—Au1 107.16 (16) C32—C31—P2 122.9 (4)
C7—P1—Au1 116.0 (14) C36—C31—P2 119.3 (4)
C25—P2—C31 108.1 (2) C33—C32—C31 120.5 (5)
C25—P2—C3 106.5 (2) C33—C32—H33 119.8
C31—P2—C3 105.6 (2) C31—C32—H33 119.8
C25—P2—Au2 112.19 (17) C34—C33—C32 121.2 (6)
C31—P2—Au2 113.28 (16) C34—C33—H34 119.4
C3—P2—Au2 110.65 (16) C32—C33—H34 119.4
C43—P3—C37 106.5 (2) C33—C34—C35 119.5 (6)
C43—P3—C4 106.4 (2) C33—C34—H35 120.2
C37—P3—C4 105.2 (2) C35—C34—H35 120.2
C43—P3—Au1 110.24 (15) C36—C35—C34 119.7 (5)
C37—P3—Au1 112.76 (18) C36—C35—H36 120.1
C4—P3—Au1 115.17 (16) C34—C35—H36 120.1
C49—P4—C6 107.6 (2) C35—C36—C31 121.5 (5)
C49—P4—C55 103.2 (2) C35—C36—H37 119.2
C6—P4—C55 108.8 (2) C31—C36—H37 119.2
C49—P4—Au2 112.99 (16) C42—C37—C38 119.4 (5)
C6—P4—Au2 111.52 (16) C42—C37—P3 120.6 (4)
C55—P4—Au2 112.28 (17) C38—C37—P3 119.9 (4)
C2—C1—P1 111.4 (3) C37—C38—C39 121.0 (6)
C2—C1—H1 109.4 C37—C38—H38 119.5
P1—C1—H1 109.4 C39—C38—H38 119.5
C2—C1—H2 109.4 C40—C39—C38 118.7 (6)
P1—C1—H2 109.4 C40—C39—H39 120.6
H1—C1—H2 108.0 C38—C39—H39 120.6
C1—C2—C3 113.7 (4) C41—C40—C39 120.9 (6)
C1—C2—H3 108.8 C41—C40—H40 119.5
C3—C2—H3 108.8 C39—C40—H40 119.5
C1—C2—H4 108.8 C40—C41—C42 120.1 (6)
C3—C2—H4 108.8 C40—C41—H41 120.0
H3—C2—H4 107.7 C42—C41—H41 120.0
C2—C3—P2 109.0 (3) C37—C42—C41 119.9 (6)
C2—C3—H5 109.9 C37—C42—H42 120.1
P2—C3—H5 109.9 C41—C42—H42 120.1
C2—C3—H6 109.9 C48—C43—C44 118.4 (4)
P2—C3—H6 109.9 C48—C43—P3 122.4 (4)
H5—C3—H6 108.3 C44—C43—P3 118.7 (4)
C5—C4—P3 112.7 (3) C45—C44—C43 120.5 (5)
C5—C4—H7 109.1 C45—C44—H43 119.7
P3—C4—H7 109.1 C43—C44—H43 119.7
C5—C4—H8 109.1 C46—C45—C44 120.7 (5)
P3—C4—H8 109.1 C46—C45—H44 119.7
H7—C4—H8 107.8 C44—C45—H44 119.7
C6—C5—C4 112.2 (4) C45—C46—C47 119.7 (5)
C6—C5—H9 109.2 C45—C46—H45 120.2
C4—C5—H9 109.2 C47—C46—H45 120.2
C6—C5—H10 109.2 C46—C47—C48 120.4 (5)
C4—C5—H10 109.2 C46—C47—H46 119.8
H9—C5—H10 107.9 C48—C47—H46 119.8
C5—C6—P4 111.6 (3) C43—C48—C47 120.4 (5)
C5—C6—H11 109.3 C43—C48—H47 119.8
P4—C6—H11 109.3 C47—C48—H47 119.8
C5—C6—H12 109.3 C54—C49—C50 119.4 (5)
P4—C6—H12 109.3 C54—C49—P4 118.5 (4)
H11—C6—H12 108.0 C50—C49—P4 122.1 (4)
C8—C7—C12 120 (4) C51—C50—C49 118.5 (5)
C8—C7—P1 119 (3) C51—C50—H48 120.8
C12—C7—P1 121 (3) C49—C50—H48 120.8
C7—C8—C9 119 (2) C52—C51—C50 121.0 (5)
C7—C8—H13 120.4 C52—C51—H49 119.5
C9—C8—H13 120.4 C50—C51—H49 119.5
C10—C9—C8 119 (2) C51—C52—C53 120.1 (5)
C10—C9—H14 120.4 C51—C52—H50 120.0
C8—C9—H14 120.4 C53—C52—H50 120.0
C11—C10—C9 121 (2) C54—C53—C52 119.9 (5)
C11—C10—H15 119.5 C54—C53—H51 120.0
C9—C10—H15 119.5 C52—C53—H51 120.0
C10—C11—C12 120.6 (17) C53—C54—C49 121.0 (5)
C10—C11—H16 119.7 C53—C54—H52 119.5
C12—C11—H16 119.7 C49—C54—H52 119.5
C7—C12—C11 120 (3) C60—C55—C56 119.7 (5)
C7—C12—H17 120.0 C60—C55—P4 119.3 (4)
C11—C12—H17 120.0 C56—C55—P4 120.9 (4)
C18—C13—C14 117 (3) C57—C56—C55 119.7 (6)
C18—C13—P1 121 (2) C57—C56—H53 120.2
C14—C13—P1 121 (2) C55—C56—H53 120.2
C15—C14—C13 121.8 (18) C58—C57—C56 120.8 (6)
C15—C14—H18 119.1 C58—C57—H54 119.6
C13—C14—H18 119.1 C56—C57—H54 119.6
C14—C15—C16 116.9 (19) C57—C58—C59 120.7 (6)
C14—C15—H19 121.5 C57—C58—H55 119.7
C16—C15—H19 121.5 C59—C58—H55 119.7
C17—C16—C15 122 (2) C58—C59—C60 119.4 (6)
C17—C16—H20 119.0 C58—C59—H56 120.3
C15—C16—H20 119.0 C60—C59—H56 120.3
C16—C17—C18 119.7 (15) C55—C60—C59 119.7 (6)
C16—C17—H21 120.1 C55—C60—H57 120.1
C18—C17—H21 120.1 C59—C60—H57 120.1
C13—C18—C17 122 (2) Cl4—Ni1—Cl2 104.33 (6)
C13—C18—H22 118.9 Cl4—Ni1—Cl1 106.27 (6)
C17—C18—H22 118.9 Cl2—Ni1—Cl1 104.24 (7)
C24—C19—C20 119.1 (5) Cl4—Ni1—Cl3 124.65 (6)
C24—C19—P1 122.6 (4) Cl2—Ni1—Cl3 109.20 (6)
C20—C19—P1 118.3 (4) Cl1—Ni1—Cl3 106.45 (6)
C21—C20—C19 119.8 (5) C61—O1—C63 116.0 (8)
C21—C20—H23 120.1 O1—C61—C62 113.0 (9)
C19—C20—H23 120.1 O1—C61—H58 109.0
C22—C21—C20 120.4 (6) C62—C61—H58 109.0
C22—C21—H24 119.8 O1—C61—H59 109.0
C20—C21—H24 119.8 C62—C61—H59 109.0
C23—C22—C21 119.7 (5) H58—C61—H59 107.8
C23—C22—H25 120.2 C61—C62—H60 109.5
C21—C22—H25 120.2 C61—C62—H61 109.5
C22—C23—C24 121.2 (6) H60—C62—H61 109.5
C22—C23—H26 119.4 C61—C62—H62 109.5
C24—C23—H26 119.4 H60—C62—H62 109.5
C23—C24—C19 119.8 (5) H61—C62—H62 109.5
C23—C24—H27 120.1 O1—C63—C64 109.2 (9)
C19—C24—H27 120.1 O1—C63—H63 109.8
C30—C25—C26 119.5 (5) C64—C63—H63 109.8
C30—C25—P2 118.2 (4) O1—C63—H64 109.8
C26—C25—P2 122.4 (4) C64—C63—H64 109.8
C25—C26—C27 119.7 (6) H63—C63—H64 108.3
C25—C26—H28 120.1 C63—C64—H65 109.5
C27—C26—H28 120.1 C63—C64—H66 109.5
C28—C27—C26 119.9 (6) H65—C64—H66 109.5
C28—C27—H29 120.1 C63—C64—H67 109.5
C26—C27—H29 120.1 H65—C64—H67 109.5
C29—C28—C27 120.1 (6) H66—C64—H67 109.5
C13—P1—C1—C2 −175.8 (10) C26—C25—C30—C29 −1.1 (9)
C19—P1—C1—C2 −64.6 (4) P2—C25—C30—C29 178.4 (5)
C7—P1—C1—C2 −177.7 (13) C25—P2—C31—C32 −91.2 (5)
Au1—P1—C1—C2 57.3 (4) C3—P2—C31—C32 22.5 (5)
P1—C1—C2—C3 −175.6 (3) Au2—P2—C31—C32 143.8 (4)
C1—C2—C3—P2 −163.2 (3) C25—P2—C31—C36 95.1 (4)
C25—P2—C3—C2 −177.4 (3) C3—P2—C31—C36 −151.1 (4)
C31—P2—C3—C2 67.7 (4) Au2—P2—C31—C36 −29.9 (4)
Au2—P2—C3—C2 −55.2 (4) C36—C31—C32—C33 −0.4 (8)
C43—P3—C4—C5 −173.8 (3) P2—C31—C32—C33 −174.2 (4)
C37—P3—C4—C5 73.4 (4) C31—C32—C33—C34 0.9 (9)
Au1—P3—C4—C5 −51.4 (4) C32—C33—C34—C35 −1.9 (10)
P3—C4—C5—C6 −177.7 (3) C33—C34—C35—C36 2.4 (9)
C4—C5—C6—P4 −162.3 (4) C34—C35—C36—C31 −2.0 (9)
C49—P4—C6—C5 −67.3 (4) C32—C31—C36—C35 1.0 (8)
C55—P4—C6—C5 −178.5 (4) P2—C31—C36—C35 175.0 (4)
Au2—P4—C6—C5 57.1 (4) C43—P3—C37—C42 −58.1 (4)
C19—P1—C7—C8 −67 (2) C4—P3—C37—C42 54.6 (4)
C1—P1—C7—C8 47 (2) Au1—P3—C37—C42 −179.1 (3)
Au1—P1—C7—C8 166.4 (17) C43—P3—C37—C38 123.6 (4)
C19—P1—C7—C12 108 (2) C4—P3—C37—C38 −123.8 (4)
C1—P1—C7—C12 −138 (2) Au1—P3—C37—C38 2.5 (4)
Au1—P1—C7—C12 −18 (3) C42—C37—C38—C39 −0.9 (8)
C12—C7—C8—C9 1 (3) P3—C37—C38—C39 177.4 (4)
P1—C7—C8—C9 176.4 (18) C37—C38—C39—C40 0.7 (8)
C7—C8—C9—C10 −3 (2) C38—C39—C40—C41 −1.0 (9)
C8—C9—C10—C11 5 (4) C39—C40—C41—C42 1.4 (9)
C9—C10—C11—C12 −6 (4) C38—C37—C42—C41 1.4 (8)
C8—C7—C12—C11 −1 (4) P3—C37—C42—C41 −177.0 (4)
P1—C7—C12—C11 −176.9 (16) C40—C41—C42—C37 −1.6 (9)
C10—C11—C12—C7 4 (3) C37—P3—C43—C48 141.5 (4)
C19—P1—C13—C18 146.0 (17) C4—P3—C43—C48 29.6 (5)
C1—P1—C13—C18 −101 (2) Au1—P3—C43—C48 −95.9 (4)
C7—P1—C13—C18 40 (31) C37—P3—C43—C44 −46.8 (4)
Au1—P1—C13—C18 18 (2) C4—P3—C43—C44 −158.7 (4)
C19—P1—C13—C14 −43.2 (19) Au1—P3—C43—C44 75.8 (4)
C1—P1—C13—C14 69.5 (16) C48—C43—C44—C45 0.2 (7)
Au1—P1—C13—C14 −171.1 (13) P3—C43—C44—C45 −171.8 (4)
C18—C13—C14—C15 −5 (2) C43—C44—C45—C46 −0.6 (8)
P1—C13—C14—C15 −176.5 (17) C44—C45—C46—C47 0.0 (8)
C13—C14—C15—C16 2 (2) C45—C46—C47—C48 1.0 (8)
C14—C15—C16—C17 2 (3) C44—C43—C48—C47 0.8 (7)
C15—C16—C17—C18 −2 (3) P3—C43—C48—C47 172.5 (4)
C14—C13—C18—C17 5 (3) C46—C47—C48—C43 −1.4 (7)
P1—C13—C18—C17 176.5 (14) C6—P4—C49—C54 155.1 (4)
C16—C17—C18—C13 −2 (2) C55—P4—C49—C54 −89.9 (4)
C13—P1—C19—C24 85.3 (12) Au2—P4—C49—C54 31.6 (4)
C1—P1—C19—C24 −25.6 (5) C6—P4—C49—C50 −26.1 (5)
C7—P1—C19—C24 88.2 (15) C55—P4—C49—C50 88.8 (4)
Au1—P1—C19—C24 −143.6 (4) Au2—P4—C49—C50 −149.6 (4)
C13—P1—C19—C20 −94.0 (12) C54—C49—C50—C51 1.1 (7)
C1—P1—C19—C20 155.1 (4) P4—C49—C50—C51 −177.7 (4)
C7—P1—C19—C20 −91.0 (15) C49—C50—C51—C52 −0.6 (8)
Au1—P1—C19—C20 37.1 (4) C50—C51—C52—C53 0.6 (8)
C24—C19—C20—C21 −0.6 (8) C51—C52—C53—C54 −1.2 (8)
P1—C19—C20—C21 178.7 (4) C52—C53—C54—C49 1.7 (8)
C19—C20—C21—C22 1.1 (8) C50—C49—C54—C53 −1.7 (7)
C20—C21—C22—C23 −1.5 (9) P4—C49—C54—C53 177.1 (4)
C21—C22—C23—C24 1.4 (9) C49—P4—C55—C60 92.3 (5)
C22—C23—C24—C19 −0.9 (9) C6—P4—C55—C60 −153.6 (5)
C20—C19—C24—C23 0.5 (8) Au2—P4—C55—C60 −29.7 (5)
P1—C19—C24—C23 −178.7 (4) C49—P4—C55—C56 −83.7 (5)
C31—P2—C25—C30 −167.5 (5) C6—P4—C55—C56 30.4 (5)
C3—P2—C25—C30 79.4 (5) Au2—P4—C55—C56 154.3 (4)
Au2—P2—C25—C30 −41.8 (5) C60—C55—C56—C57 −0.7 (9)
C31—P2—C25—C26 12.0 (5) P4—C55—C56—C57 175.3 (5)
C3—P2—C25—C26 −101.1 (5) C55—C56—C57—C58 −0.4 (9)
Au2—P2—C25—C26 137.7 (4) C56—C57—C58—C59 0.7 (11)
C30—C25—C26—C27 2.1 (8) C57—C58—C59—C60 0.0 (11)
P2—C25—C26—C27 −177.4 (4) C56—C55—C60—C59 1.4 (9)
C25—C26—C27—C28 −2.2 (9) P4—C55—C60—C59 −174.6 (5)
C26—C27—C28—C29 1.3 (11) C58—C59—C60—C55 −1.1 (10)
C27—C28—C29—C30 −0.2 (12) C63—O1—C61—C62 −178.7 (9)
C28—C29—C30—C25 0.1 (11) C61—O1—C63—C64 −171.8 (9)

Footnotes

Supplementary data and figures for this paper are available from the IUCr electronic archives (Reference: GK2571).

References

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Associated Data

This section collects any data citations, data availability statements, or supplementary materials included in this article.

Supplementary Materials

Crystal structure: contains datablock(s) I, global. DOI: 10.1107/S1600536813013470/gk2571sup1.cif

e-69-0m339-sup1.cif (55.5KB, cif)

Structure factors: contains datablock(s) I. DOI: 10.1107/S1600536813013470/gk2571Isup2.hkl

e-69-0m339-Isup2.hkl (648.8KB, hkl)

Additional supplementary materials: crystallographic information; 3D view; checkCIF report


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