Abstract
The phosphine-coordinated AgI atom in the title compound, [Ag(C21H17BN6)(C18H15P)], is also N,N′,N′′-chelated by the tris(indazolyl)borate anion. The resultant N3P coordination geometry is tetrahedral.
Related literature
For related literature; see Janiak et al. (2000 ▶).
Experimental
Crystal data
[Ag(C21H17BN6)(C18H15P)]
M r = 734.36
Triclinic,
a = 10.2950 (6) Å
b = 12.6644 (6) Å
c = 13.9555 (7) Å
α = 87.003 (1)°
β = 77.966 (2)°
γ = 79.903 (1)°
V = 1751.7 (2) Å3
Z = 2
Mo Kα radiation
μ = 0.66 mm−1
T = 295 (2) K
0.31 × 0.28 × 0.15 mm
Data collection
Rigaku R-AXIS RAPID IP diffractometer
Absorption correction: multi-scan (ABSCOR; Higashi, 1995 ▶) T min = 0.551, T max = 0.908
17380 measured reflections
7925 independent reflections
4255 reflections with I > 2σ(I)
R int = 0.038
Refinement
R[F 2 > 2σ(F 2)] = 0.044
wR(F 2) = 0.159
S = 1.08
7925 reflections
433 parameters
H-atom parameters constrained
Δρmax = 0.87 e Å−3
Δρmin = −0.95 e Å−3
Data collection: RAPID-AUTO (Rigaku Corporation, 1998 ▶); cell refinement: RAPID-AUTO; data reduction: CrystalStructure (Rigaku/MSC, 2002 ▶); program(s) used to solve structure: SHELXS97 (Sheldrick, 1997 ▶); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997 ▶); molecular graphics: X-SEED (Barbour, 2001 ▶); software used to prepare material for publication: publCIF (Westrip, 2007 ▶).
Supplementary Material
Crystal structure: contains datablocks global, I. DOI: 10.1107/S1600536807064239/tk2225sup1.cif
Structure factors: contains datablocks I. DOI: 10.1107/S1600536807064239/tk2225Isup2.hkl
Additional supplementary materials: crystallographic information; 3D view; checkCIF report
Acknowledgments
We thank the Research Office of Azarbaijan University of Tarbiat Moallem, the Heilongjiang Province Natural Science Foundation (No. B200501), the Scientific Fund for Remarkable Teachers of Heilongjiang Province (No. 1054 G036) and the University of Malaya for supporting this study.
supplementary crystallographic information
Comment
Hydrotris(indazolyl)borate, Tp4Bo, is suggested to be a suitable tripodal ligand for supramolecular assembly (Janiak et al., 2000). In the title silver derivative, Ag(C21H17N6B)(C18H15P), the Tp4Bo anion functions as a tridentate ligand (Fig. 1). The triphenylphosphine ligand completes the N3P coordination geometry for Ag. The Ag center is tetrahedrally coordinated, but the N–Ag–N angles are significantly less than 90°, i.e. range from 82.3 (1) to 83.8 (2)°.
Experimental
Under a dry nitrogen atmosphere, K[HB(Indazolyl)3] (0.2 g, 1 mmol) was added to a mixture of AgNO3 (0.17 g, 1 mmol) and PPh3 (0.26 g, 2 mmol) in methanol (40 ml). After being stirred for 3 h, the colorless solution was filtered. Crystals were obtained from the filtrate after a week.
Refinement
The H atoms were included in the refinement in the riding model approximation with = C–H 0.93, and with U(H) = 1.2Ueq(C).
Figures
Fig. 1.
The molecular structure of (I) showing atom numbering scheme, displacement ellipsoids at the 50% probability level and H atoms as spheres of arbitrary radii.
Crystal data
| [Ag(C21H17BN6)(C18H15P)] | Z = 2 |
| Mr = 734.36 | F(000) = 750 |
| Triclinic, P1 | Dx = 1.392 Mg m−3 |
| Hall symbol: -P 1 | Mo Kα radiation, λ = 0.71073 Å |
| a = 10.2950 (6) Å | Cell parameters from 10642 reflections |
| b = 12.6644 (6) Å | θ = 3.0–27.5° |
| c = 13.9555 (7) Å | µ = 0.66 mm−1 |
| α = 87.003 (1)° | T = 295 K |
| β = 77.966 (2)° | Block, colorless |
| γ = 79.903 (1)° | 0.31 × 0.28 × 0.15 mm |
| V = 1751.7 (2) Å3 |
Data collection
| Rigaku R-AXIS RAPID IP diffractometer | 7925 independent reflections |
| Radiation source: fine-focus sealed tube | 4255 reflections with I > 2σ(I) |
| graphite | Rint = 0.038 |
| ω scans | θmax = 27.5°, θmin = 3.0° |
| Absorption correction: multi-scan (ABSCOR; Higashi, 1995) | h = −13→13 |
| Tmin = 0.551, Tmax = 0.908 | k = −16→14 |
| 17380 measured reflections | l = −18→17 |
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)] = 0.044 | Hydrogen site location: inferred from neighbouring sites |
| wR(F2) = 0.159 | H-atom parameters constrained |
| S = 1.08 | w = 1/[σ2(Fo2) + (0.0652P)2 + 1.2113P] where P = (Fo2 + 2Fc2)/3 |
| 7925 reflections | (Δ/σ)max = 0.001 |
| 433 parameters | Δρmax = 0.87 e Å−3 |
| 0 restraints | Δρmin = −0.95 e Å−3 |
Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2)
| x | y | z | Uiso*/Ueq | ||
| Ag1 | 0.46371 (4) | 0.69276 (3) | 0.81804 (3) | 0.06680 (17) | |
| P1 | 0.28241 (12) | 0.80700 (9) | 0.90871 (9) | 0.0525 (3) | |
| N1 | 0.5981 (4) | 0.7791 (3) | 0.6910 (3) | 0.0682 (11) | |
| N2 | 0.7025 (4) | 0.7136 (3) | 0.6353 (3) | 0.0587 (9) | |
| N3 | 0.4898 (4) | 0.5627 (3) | 0.7017 (3) | 0.0660 (11) | |
| N4 | 0.6162 (4) | 0.5350 (3) | 0.6461 (3) | 0.0610 (10) | |
| N5 | 0.6709 (4) | 0.5973 (3) | 0.8415 (3) | 0.0637 (10) | |
| N6 | 0.7627 (4) | 0.5686 (3) | 0.7583 (3) | 0.0590 (9) | |
| C1 | 0.6028 (6) | 0.8787 (4) | 0.6578 (4) | 0.0772 (15) | |
| H1 | 0.5422 | 0.9386 | 0.6837 | 0.093* | |
| C2 | 0.7101 (6) | 0.8818 (4) | 0.5794 (4) | 0.0704 (14) | |
| C3 | 0.7642 (8) | 0.9632 (6) | 0.5185 (5) | 0.105 (2) | |
| H3 | 0.7241 | 1.0349 | 0.5260 | 0.126* | |
| C4 | 0.8754 (10) | 0.9333 (8) | 0.4497 (6) | 0.132 (3) | |
| H4 | 0.9140 | 0.9858 | 0.4102 | 0.158* | |
| C5 | 0.9350 (8) | 0.8255 (8) | 0.4357 (6) | 0.125 (3) | |
| H5 | 1.0101 | 0.8080 | 0.3856 | 0.150* | |
| C6 | 0.8851 (6) | 0.7453 (6) | 0.4941 (4) | 0.0890 (17) | |
| H6 | 0.9253 | 0.6739 | 0.4849 | 0.107* | |
| C7 | 0.7729 (5) | 0.7747 (4) | 0.5670 (4) | 0.0638 (12) | |
| C8 | 0.4152 (6) | 0.4946 (4) | 0.6823 (4) | 0.0736 (14) | |
| H8 | 0.3245 | 0.4971 | 0.7101 | 0.088* | |
| C9 | 0.4908 (6) | 0.4181 (4) | 0.6143 (4) | 0.0672 (13) | |
| C10 | 0.4641 (8) | 0.3292 (5) | 0.5697 (5) | 0.0900 (19) | |
| H10 | 0.3785 | 0.3108 | 0.5828 | 0.108* | |
| C11 | 0.5667 (10) | 0.2717 (5) | 0.5075 (5) | 0.104 (2) | |
| H11 | 0.5511 | 0.2126 | 0.4774 | 0.125* | |
| C12 | 0.6947 (9) | 0.2981 (5) | 0.4871 (4) | 0.100 (2) | |
| H12 | 0.7627 | 0.2556 | 0.4442 | 0.120* | |
| C13 | 0.7254 (7) | 0.3861 (4) | 0.5285 (4) | 0.0816 (17) | |
| H13 | 0.7589 | 0.4337 | 0.4760 | 0.098* | |
| H13B | 0.7977 | 0.3609 | 0.5632 | 0.098* | |
| C14 | 0.6182 (6) | 0.4457 (4) | 0.5935 (3) | 0.0615 (12) | |
| C15 | 0.7202 (6) | 0.5533 (4) | 0.9166 (4) | 0.0696 (13) | |
| H15 | 0.6759 | 0.5614 | 0.9817 | 0.083* | |
| C16 | 0.8488 (5) | 0.4923 (4) | 0.8855 (4) | 0.0686 (13) | |
| C17 | 0.9442 (6) | 0.4265 (4) | 0.9313 (5) | 0.0844 (17) | |
| H17 | 0.9291 | 0.4168 | 0.9990 | 0.101* | |
| C18 | 1.0592 (7) | 0.3777 (5) | 0.8726 (7) | 0.101 (2) | |
| H18 | 1.1232 | 0.3333 | 0.9011 | 0.121* | |
| C19 | 1.0845 (6) | 0.3920 (5) | 0.7716 (6) | 0.096 (2) | |
| H19 | 1.1655 | 0.3584 | 0.7344 | 0.115* | |
| C20 | 0.9923 (5) | 0.4547 (4) | 0.7253 (5) | 0.0768 (15) | |
| H20 | 1.0093 | 0.4637 | 0.6575 | 0.092* | |
| C21 | 0.8725 (5) | 0.5043 (3) | 0.7836 (4) | 0.0619 (12) | |
| C22 | 0.1187 (5) | 0.7991 (3) | 0.8834 (3) | 0.0576 (11) | |
| C23 | 0.1166 (6) | 0.7634 (5) | 0.7923 (4) | 0.0804 (15) | |
| H23 | 0.1973 | 0.7414 | 0.7486 | 0.096* | |
| C24 | −0.0051 (7) | 0.7600 (6) | 0.7647 (5) | 0.099 (2) | |
| H24 | −0.0047 | 0.7364 | 0.7027 | 0.119* | |
| C25 | −0.1241 (7) | 0.7907 (5) | 0.8274 (5) | 0.0873 (17) | |
| H25 | −0.2053 | 0.7902 | 0.8083 | 0.105* | |
| C26 | −0.1224 (5) | 0.8227 (5) | 0.9196 (5) | 0.0811 (16) | |
| H26 | −0.2033 | 0.8413 | 0.9640 | 0.097* | |
| C27 | −0.0024 (5) | 0.8276 (4) | 0.9475 (4) | 0.0654 (12) | |
| H27 | −0.0034 | 0.8504 | 1.0100 | 0.079* | |
| C28 | 0.3049 (4) | 0.9449 (3) | 0.8736 (3) | 0.0495 (10) | |
| C29 | 0.2260 (6) | 1.0098 (4) | 0.8192 (4) | 0.0774 (15) | |
| H29 | 0.1512 | 0.9871 | 0.8048 | 0.093* | |
| C30 | 0.2568 (7) | 1.1094 (4) | 0.7852 (5) | 0.094 (2) | |
| H30 | 0.2043 | 1.1516 | 0.7461 | 0.113* | |
| C31 | 0.3624 (7) | 1.1457 (4) | 0.8083 (5) | 0.0825 (16) | |
| H31 | 0.3813 | 1.2130 | 0.7865 | 0.099* | |
| C32 | 0.4409 (6) | 1.0826 (4) | 0.8639 (4) | 0.0731 (14) | |
| H32 | 0.5135 | 1.1071 | 0.8801 | 0.088* | |
| C33 | 0.4127 (5) | 0.9823 (4) | 0.8963 (4) | 0.0626 (12) | |
| H33 | 0.4670 | 0.9396 | 0.9338 | 0.075* | |
| C34 | 0.2676 (5) | 0.8030 (4) | 1.0407 (3) | 0.0563 (11) | |
| C35 | 0.3329 (5) | 0.7129 (4) | 1.0828 (4) | 0.0667 (13) | |
| H35 | 0.3793 | 0.6558 | 1.0435 | 0.080* | |
| C36 | 0.3300 (7) | 0.7069 (5) | 1.1818 (5) | 0.0879 (18) | |
| H36 | 0.3739 | 0.6458 | 1.2090 | 0.105* | |
| C37 | 0.2629 (7) | 0.7904 (6) | 1.2403 (4) | 0.093 (2) | |
| H37 | 0.2615 | 0.7861 | 1.3072 | 0.111* | |
| C38 | 0.1973 (6) | 0.8808 (6) | 1.2007 (4) | 0.0872 (17) | |
| H38 | 0.1517 | 0.9376 | 1.2408 | 0.105* | |
| C39 | 0.1992 (5) | 0.8872 (4) | 1.1014 (4) | 0.0692 (13) | |
| H39 | 0.1545 | 0.9484 | 1.0749 | 0.083* | |
| B1 | 0.7306 (5) | 0.5929 (4) | 0.6564 (4) | 0.0608 (14) | |
| H1B | 0.8105 | 0.5624 | 0.6084 | 0.073* |
Atomic displacement parameters (Å2)
| U11 | U22 | U33 | U12 | U13 | U23 | |
| Ag1 | 0.0566 (2) | 0.0586 (2) | 0.0756 (3) | −0.00108 (16) | 0.00227 (18) | −0.00611 (17) |
| P1 | 0.0478 (7) | 0.0523 (6) | 0.0537 (7) | −0.0065 (5) | −0.0036 (5) | −0.0012 (5) |
| N1 | 0.068 (3) | 0.059 (2) | 0.066 (3) | −0.0076 (19) | 0.008 (2) | −0.0010 (19) |
| N2 | 0.054 (2) | 0.064 (2) | 0.055 (2) | −0.0135 (18) | −0.0013 (18) | −0.0005 (18) |
| N3 | 0.060 (3) | 0.060 (2) | 0.079 (3) | −0.0117 (19) | −0.013 (2) | −0.010 (2) |
| N4 | 0.061 (3) | 0.059 (2) | 0.062 (2) | −0.0072 (18) | −0.013 (2) | −0.0086 (19) |
| N5 | 0.056 (2) | 0.066 (2) | 0.064 (2) | 0.0058 (18) | −0.014 (2) | −0.0028 (19) |
| N6 | 0.045 (2) | 0.065 (2) | 0.064 (2) | −0.0014 (17) | −0.0100 (19) | −0.0067 (18) |
| C1 | 0.089 (4) | 0.055 (3) | 0.079 (4) | −0.007 (3) | −0.001 (3) | −0.001 (3) |
| C2 | 0.075 (4) | 0.076 (3) | 0.059 (3) | −0.024 (3) | −0.003 (3) | 0.004 (2) |
| C3 | 0.130 (6) | 0.096 (5) | 0.083 (4) | −0.035 (4) | 0.003 (4) | 0.012 (4) |
| C4 | 0.143 (8) | 0.134 (7) | 0.112 (6) | −0.054 (6) | 0.008 (6) | 0.034 (5) |
| C5 | 0.104 (6) | 0.160 (8) | 0.093 (5) | −0.036 (5) | 0.029 (4) | 0.018 (5) |
| C6 | 0.075 (4) | 0.107 (4) | 0.075 (4) | −0.016 (3) | 0.007 (3) | −0.003 (3) |
| C7 | 0.057 (3) | 0.078 (3) | 0.058 (3) | −0.016 (2) | −0.009 (2) | −0.006 (2) |
| C8 | 0.065 (3) | 0.069 (3) | 0.091 (4) | −0.014 (3) | −0.025 (3) | 0.003 (3) |
| C9 | 0.083 (4) | 0.063 (3) | 0.066 (3) | −0.017 (3) | −0.037 (3) | 0.004 (2) |
| C10 | 0.125 (6) | 0.076 (4) | 0.085 (4) | −0.027 (4) | −0.052 (4) | 0.002 (3) |
| C11 | 0.165 (8) | 0.081 (4) | 0.085 (5) | −0.029 (5) | −0.058 (5) | −0.008 (4) |
| C12 | 0.153 (7) | 0.083 (4) | 0.060 (4) | 0.002 (4) | −0.027 (4) | −0.021 (3) |
| C13 | 0.117 (5) | 0.078 (3) | 0.046 (3) | 0.001 (3) | −0.023 (3) | −0.001 (3) |
| C14 | 0.080 (4) | 0.057 (3) | 0.050 (3) | −0.004 (2) | −0.026 (3) | 0.000 (2) |
| C15 | 0.073 (4) | 0.064 (3) | 0.072 (3) | −0.009 (3) | −0.019 (3) | −0.004 (2) |
| C16 | 0.069 (3) | 0.051 (3) | 0.092 (4) | −0.014 (2) | −0.027 (3) | 0.003 (3) |
| C17 | 0.087 (4) | 0.066 (3) | 0.109 (5) | −0.015 (3) | −0.041 (4) | 0.013 (3) |
| C18 | 0.074 (4) | 0.077 (4) | 0.153 (7) | −0.003 (3) | −0.039 (5) | 0.017 (4) |
| C19 | 0.061 (4) | 0.070 (4) | 0.147 (7) | 0.003 (3) | −0.011 (4) | 0.004 (4) |
| C20 | 0.058 (3) | 0.067 (3) | 0.102 (4) | −0.004 (2) | −0.011 (3) | −0.005 (3) |
| C21 | 0.051 (3) | 0.049 (2) | 0.088 (4) | −0.011 (2) | −0.016 (3) | −0.004 (2) |
| C22 | 0.070 (3) | 0.051 (2) | 0.052 (3) | −0.016 (2) | −0.008 (2) | 0.000 (2) |
| C23 | 0.073 (4) | 0.103 (4) | 0.069 (4) | −0.024 (3) | −0.011 (3) | −0.018 (3) |
| C24 | 0.100 (5) | 0.127 (5) | 0.085 (4) | −0.036 (4) | −0.035 (4) | −0.024 (4) |
| C25 | 0.084 (4) | 0.085 (4) | 0.107 (5) | −0.028 (3) | −0.038 (4) | −0.005 (4) |
| C26 | 0.045 (3) | 0.088 (4) | 0.110 (5) | −0.019 (3) | −0.006 (3) | −0.006 (3) |
| C27 | 0.055 (3) | 0.074 (3) | 0.067 (3) | −0.012 (2) | −0.008 (2) | −0.010 (2) |
| C28 | 0.044 (2) | 0.057 (2) | 0.046 (2) | −0.0053 (18) | −0.0074 (19) | −0.0032 (18) |
| C29 | 0.079 (4) | 0.065 (3) | 0.098 (4) | −0.014 (3) | −0.041 (3) | 0.009 (3) |
| C30 | 0.104 (5) | 0.062 (3) | 0.132 (6) | −0.022 (3) | −0.060 (4) | 0.026 (3) |
| C31 | 0.098 (4) | 0.058 (3) | 0.095 (4) | −0.022 (3) | −0.025 (4) | 0.019 (3) |
| C32 | 0.074 (4) | 0.074 (3) | 0.075 (3) | −0.032 (3) | −0.008 (3) | 0.002 (3) |
| C33 | 0.057 (3) | 0.073 (3) | 0.059 (3) | −0.018 (2) | −0.012 (2) | 0.005 (2) |
| C34 | 0.051 (3) | 0.062 (3) | 0.056 (3) | −0.014 (2) | −0.008 (2) | 0.004 (2) |
| C35 | 0.070 (3) | 0.060 (3) | 0.075 (3) | −0.019 (2) | −0.021 (3) | 0.014 (2) |
| C36 | 0.099 (5) | 0.096 (4) | 0.081 (4) | −0.040 (4) | −0.036 (4) | 0.032 (4) |
| C37 | 0.096 (5) | 0.136 (6) | 0.057 (3) | −0.055 (4) | −0.019 (3) | 0.022 (4) |
| C38 | 0.077 (4) | 0.125 (5) | 0.057 (3) | −0.023 (4) | 0.000 (3) | −0.006 (3) |
| C39 | 0.064 (3) | 0.081 (3) | 0.060 (3) | −0.011 (3) | −0.009 (3) | 0.003 (3) |
| B1 | 0.041 (3) | 0.071 (3) | 0.068 (4) | −0.003 (2) | −0.006 (3) | −0.014 (3) |
Geometric parameters (Å, °)
| Ag1—N1 | 2.358 (4) | C15—H15 | 0.9300 |
| Ag1—N3 | 2.316 (4) | C16—C21 | 1.397 (7) |
| Ag1—N5 | 2.337 (4) | C16—C17 | 1.410 (7) |
| Ag1—P1 | 2.332 (1) | C17—C18 | 1.359 (9) |
| P1—C22 | 1.814 (5) | C17—H17 | 0.9300 |
| P1—C34 | 1.814 (5) | C18—C19 | 1.387 (10) |
| P1—C28 | 1.830 (4) | C18—H18 | 0.9300 |
| N1—C1 | 1.326 (6) | C19—C20 | 1.373 (8) |
| N1—N2 | 1.361 (5) | C19—H19 | 0.9300 |
| N2—C7 | 1.365 (6) | C20—C21 | 1.394 (7) |
| N2—B1 | 1.529 (7) | C20—H20 | 0.9300 |
| N3—C8 | 1.322 (6) | C22—C27 | 1.377 (7) |
| N3—N4 | 1.366 (5) | C22—C23 | 1.377 (7) |
| N4—C14 | 1.375 (6) | C23—C24 | 1.393 (8) |
| N4—B1 | 1.526 (7) | C23—H23 | 0.9300 |
| N5—C15 | 1.316 (6) | C24—C25 | 1.356 (9) |
| N5—N6 | 1.356 (5) | C24—H24 | 0.9300 |
| N6—C21 | 1.370 (6) | C25—C26 | 1.373 (8) |
| N6—B1 | 1.531 (7) | C25—H25 | 0.9300 |
| C1—C2 | 1.388 (7) | C26—C27 | 1.383 (7) |
| C1—H1 | 0.9300 | C26—H26 | 0.9300 |
| C2—C7 | 1.400 (7) | C27—H27 | 0.9300 |
| C2—C3 | 1.416 (8) | C28—C29 | 1.368 (6) |
| C3—C4 | 1.343 (11) | C28—C33 | 1.379 (6) |
| C3—H3 | 0.9300 | C29—C30 | 1.390 (7) |
| C4—C5 | 1.401 (11) | C29—H29 | 0.9300 |
| C4—H4 | 0.9300 | C30—C31 | 1.354 (8) |
| C5—C6 | 1.372 (9) | C30—H30 | 0.9300 |
| C5—H5 | 0.9300 | C31—C32 | 1.365 (8) |
| C6—C7 | 1.382 (7) | C31—H31 | 0.9300 |
| C6—H6 | 0.9300 | C32—C33 | 1.385 (7) |
| C8—C9 | 1.403 (7) | C32—H32 | 0.9300 |
| C8—H8 | 0.9300 | C33—H33 | 0.9300 |
| C9—C14 | 1.386 (7) | C34—C39 | 1.391 (7) |
| C9—C10 | 1.408 (7) | C34—C35 | 1.387 (6) |
| C10—C11 | 1.347 (10) | C35—C36 | 1.374 (8) |
| C10—H10 | 0.9300 | C35—H35 | 0.9300 |
| C11—C12 | 1.385 (10) | C36—C37 | 1.364 (9) |
| C11—H11 | 0.9300 | C36—H36 | 0.9300 |
| C12—C13 | 1.394 (8) | C37—C38 | 1.376 (9) |
| C12—H12 | 0.9300 | C37—H37 | 0.9300 |
| C13—C14 | 1.404 (7) | C38—C39 | 1.380 (7) |
| C13—H13 | 0.9700 | C38—H38 | 0.9300 |
| C13—H13B | 0.9700 | C39—H39 | 0.9300 |
| C15—C16 | 1.405 (7) | B1—H1B | 0.9800 |
| N1—Ag1—N3 | 83.8 (2) | C21—C16—C15 | 103.7 (4) |
| N1—Ag1—N5 | 83.7 (2) | C21—C16—C17 | 120.4 (5) |
| N1—Ag1—P1 | 114.3 (1) | C15—C16—C17 | 135.8 (6) |
| N3—Ag1—N5 | 82.3 (1) | C18—C17—C16 | 117.3 (6) |
| N3—Ag1—P1 | 135.6 (1) | C18—C17—H17 | 121.3 |
| N5—Ag1—P1 | 137.2 (1) | C16—C17—H17 | 121.3 |
| C22—P1—C34 | 108.0 (2) | C17—C18—C19 | 122.3 (6) |
| C22—P1—C28 | 103.7 (2) | C17—C18—H18 | 118.9 |
| C34—P1—C28 | 104.0 (2) | C19—C18—H18 | 118.9 |
| C22—P1—Ag1 | 115.48 (15) | C20—C19—C18 | 121.4 (6) |
| C34—P1—Ag1 | 116.65 (15) | C20—C19—H19 | 119.3 |
| C28—P1—Ag1 | 107.61 (14) | C18—C19—H19 | 119.3 |
| C1—N1—N2 | 107.6 (4) | C19—C20—C21 | 117.5 (6) |
| C1—N1—Ag1 | 137.0 (3) | C19—C20—H20 | 121.2 |
| N2—N1—Ag1 | 115.3 (3) | C21—C20—H20 | 121.2 |
| N1—N2—C7 | 108.7 (4) | N6—C21—C20 | 130.5 (5) |
| N1—N2—B1 | 121.5 (4) | N6—C21—C16 | 108.5 (4) |
| C7—N2—B1 | 129.7 (4) | C20—C21—C16 | 121.0 (5) |
| C8—N3—N4 | 107.6 (4) | C27—C22—C23 | 118.2 (5) |
| C8—N3—Ag1 | 135.3 (4) | C27—C22—P1 | 124.9 (4) |
| N4—N3—Ag1 | 116.4 (3) | C23—C22—P1 | 116.9 (4) |
| N3—N4—C14 | 108.3 (4) | C22—C23—C24 | 120.7 (6) |
| N3—N4—B1 | 121.1 (4) | C22—C23—H23 | 119.6 |
| C14—N4—B1 | 130.3 (4) | C24—C23—H23 | 119.6 |
| C15—N5—N6 | 108.3 (4) | C25—C24—C23 | 120.8 (6) |
| C15—N5—Ag1 | 136.0 (4) | C25—C24—H24 | 119.6 |
| N6—N5—Ag1 | 115.3 (3) | C23—C24—H24 | 119.6 |
| N5—N6—C21 | 108.4 (4) | C24—C25—C26 | 118.7 (6) |
| N5—N6—B1 | 122.2 (4) | C24—C25—H25 | 120.7 |
| C21—N6—B1 | 128.7 (4) | C26—C25—H25 | 120.7 |
| N1—C1—C2 | 111.2 (5) | C27—C26—C25 | 121.2 (6) |
| N1—C1—H1 | 124.4 | C27—C26—H26 | 119.4 |
| C2—C1—H1 | 124.4 | C25—C26—H26 | 119.4 |
| C1—C2—C7 | 104.3 (4) | C22—C27—C26 | 120.4 (5) |
| C1—C2—C3 | 135.7 (6) | C22—C27—H27 | 119.8 |
| C7—C2—C3 | 120.0 (6) | C26—C27—H27 | 119.8 |
| C4—C3—C2 | 117.7 (7) | C29—C28—C33 | 118.3 (4) |
| C4—C3—H3 | 121.2 | C29—C28—P1 | 122.9 (4) |
| C2—C3—H3 | 121.2 | C33—C28—P1 | 118.6 (3) |
| C3—C4—C5 | 121.9 (7) | C28—C29—C30 | 120.5 (5) |
| C3—C4—H4 | 119.0 | C28—C29—H29 | 119.7 |
| C5—C4—H4 | 119.0 | C30—C29—H29 | 119.7 |
| C6—C5—C4 | 121.5 (7) | C31—C30—C29 | 120.7 (5) |
| C6—C5—H5 | 119.3 | C31—C30—H30 | 119.7 |
| C4—C5—H5 | 119.3 | C29—C30—H30 | 119.7 |
| C5—C6—C7 | 117.5 (6) | C30—C31—C32 | 119.5 (5) |
| C5—C6—H6 | 121.3 | C30—C31—H31 | 120.2 |
| C7—C6—H6 | 121.3 | C32—C31—H31 | 120.2 |
| N2—C7—C6 | 130.4 (5) | C31—C32—C33 | 120.1 (5) |
| N2—C7—C2 | 108.2 (4) | C31—C32—H32 | 119.9 |
| C6—C7—C2 | 121.4 (5) | C33—C32—H32 | 119.9 |
| N3—C8—C9 | 111.3 (5) | C28—C33—C32 | 120.8 (5) |
| N3—C8—H8 | 124.4 | C28—C33—H33 | 119.6 |
| C9—C8—H8 | 124.4 | C32—C33—H33 | 119.6 |
| C14—C9—C8 | 104.1 (4) | C39—C34—C35 | 118.1 (5) |
| C14—C9—C10 | 120.7 (6) | C39—C34—P1 | 123.5 (4) |
| C8—C9—C10 | 135.2 (6) | C35—C34—P1 | 118.3 (4) |
| C11—C10—C9 | 117.8 (7) | C36—C35—C34 | 121.0 (5) |
| C11—C10—H10 | 121.1 | C36—C35—H35 | 119.5 |
| C9—C10—H10 | 121.1 | C34—C35—H35 | 119.5 |
| C10—C11—C12 | 121.8 (6) | C37—C36—C35 | 120.1 (6) |
| C10—C11—H11 | 119.1 | C37—C36—H36 | 119.9 |
| C12—C11—H11 | 119.1 | C35—C36—H36 | 119.9 |
| C11—C12—C13 | 122.4 (6) | C36—C37—C38 | 120.3 (6) |
| C11—C12—H12 | 118.8 | C36—C37—H37 | 119.9 |
| C13—C12—H12 | 118.8 | C38—C37—H37 | 119.9 |
| C12—C13—C14 | 115.6 (6) | C39—C38—C37 | 119.9 (6) |
| C12—C13—H13 | 108.4 | C39—C38—H38 | 120.0 |
| C14—C13—H13 | 108.4 | C37—C38—H38 | 120.0 |
| C12—C13—H13B | 108.4 | C38—C39—C34 | 120.5 (5) |
| C14—C13—H13B | 108.4 | C38—C39—H39 | 119.7 |
| H13—C13—H13B | 107.4 | C34—C39—H39 | 119.7 |
| N4—C14—C9 | 108.8 (4) | N4—B1—N2 | 113.6 (4) |
| N4—C14—C13 | 129.6 (5) | N4—B1—N6 | 108.9 (4) |
| C9—C14—C13 | 121.7 (5) | N2—B1—N6 | 111.7 (4) |
| N5—C15—C16 | 111.0 (5) | N4—B1—H1B | 107.4 |
| N5—C15—H15 | 124.5 | N2—B1—H1B | 107.4 |
| C16—C15—H15 | 124.5 | N6—B1—H1B | 107.4 |
| N3—Ag1—P1—C22 | −2.1 (2) | C12—C13—C14—N4 | 179.4 (5) |
| N5—Ag1—P1—C22 | −147.2 (2) | C12—C13—C14—C9 | −0.2 (7) |
| N1—Ag1—P1—C22 | 104.8 (2) | N6—N5—C15—C16 | −0.2 (6) |
| N3—Ag1—P1—C34 | 126.3 (2) | Ag1—N5—C15—C16 | 171.9 (3) |
| N5—Ag1—P1—C34 | −18.7 (2) | N5—C15—C16—C21 | 0.2 (6) |
| N1—Ag1—P1—C34 | −126.8 (2) | N5—C15—C16—C17 | −177.2 (6) |
| N3—Ag1—P1—C28 | −117.4 (2) | C21—C16—C17—C18 | 1.1 (8) |
| N5—Ag1—P1—C28 | 97.6 (2) | C15—C16—C17—C18 | 178.1 (6) |
| N1—Ag1—P1—C28 | −10.5 (2) | C16—C17—C18—C19 | 0.7 (10) |
| N3—Ag1—N1—C1 | 141.2 (6) | C17—C18—C19—C20 | −1.5 (11) |
| P1—Ag1—N1—C1 | 3.5 (6) | C18—C19—C20—C21 | 0.5 (9) |
| N5—Ag1—N1—C1 | −136.0 (6) | N5—N6—C21—C20 | 179.9 (5) |
| N3—Ag1—N1—N2 | −40.6 (3) | B1—N6—C21—C20 | 9.3 (8) |
| P1—Ag1—N1—N2 | −178.3 (3) | N5—N6—C21—C16 | 0.1 (5) |
| N5—Ag1—N1—N2 | 42.2 (3) | B1—N6—C21—C16 | −170.5 (5) |
| C1—N1—N2—C7 | 0.4 (6) | C19—C20—C21—N6 | −178.5 (5) |
| Ag1—N1—N2—C7 | −178.4 (3) | C19—C20—C21—C16 | 1.3 (8) |
| C1—N1—N2—B1 | 177.5 (5) | C15—C16—C21—N6 | −0.1 (5) |
| Ag1—N1—N2—B1 | −1.2 (5) | C17—C16—C21—N6 | 177.7 (4) |
| P1—Ag1—N3—C8 | −29.4 (6) | C15—C16—C21—C20 | 180.0 (5) |
| N5—Ag1—N3—C8 | 127.4 (5) | C17—C16—C21—C20 | −2.1 (7) |
| N1—Ag1—N3—C8 | −148.1 (5) | C34—P1—C22—C27 | 23.4 (5) |
| P1—Ag1—N3—N4 | 161.9 (2) | C28—P1—C22—C27 | −86.5 (4) |
| N5—Ag1—N3—N4 | −41.2 (3) | Ag1—P1—C22—C27 | 156.0 (4) |
| N1—Ag1—N3—N4 | 43.3 (3) | C34—P1—C22—C23 | −157.7 (4) |
| C8—N3—N4—C14 | −1.6 (5) | C28—P1—C22—C23 | 92.4 (4) |
| Ag1—N3—N4—C14 | 170.0 (3) | Ag1—P1—C22—C23 | −25.1 (4) |
| C8—N3—N4—B1 | −175.6 (4) | C27—C22—C23—C24 | 2.3 (8) |
| Ag1—N3—N4—B1 | −3.9 (5) | P1—C22—C23—C24 | −176.7 (5) |
| N3—Ag1—N5—C15 | −127.3 (5) | C22—C23—C24—C25 | −0.7 (10) |
| P1—Ag1—N5—C15 | 28.9 (6) | C23—C24—C25—C26 | −1.7 (10) |
| N1—Ag1—N5—C15 | 148.2 (5) | C24—C25—C26—C27 | 2.5 (9) |
| N3—Ag1—N5—N6 | 44.4 (3) | C23—C22—C27—C26 | −1.5 (7) |
| P1—Ag1—N5—N6 | −159.5 (2) | P1—C22—C27—C26 | 177.4 (4) |
| N1—Ag1—N5—N6 | −40.2 (3) | C25—C26—C27—C22 | −0.9 (8) |
| C15—N5—N6—C21 | 0.1 (5) | C22—P1—C28—C29 | −14.0 (5) |
| Ag1—N5—N6—C21 | −173.8 (3) | C34—P1—C28—C29 | −126.8 (4) |
| C15—N5—N6—B1 | 171.4 (4) | Ag1—P1—C28—C29 | 108.8 (4) |
| Ag1—N5—N6—B1 | −2.5 (5) | C22—P1—C28—C33 | 171.2 (4) |
| N2—N1—C1—C2 | 0.1 (7) | C34—P1—C28—C33 | 58.4 (4) |
| Ag1—N1—C1—C2 | 178.4 (4) | Ag1—P1—C28—C33 | −65.9 (4) |
| N1—C1—C2—C7 | −0.4 (7) | C33—C28—C29—C30 | 2.1 (8) |
| N1—C1—C2—C3 | −178.4 (7) | P1—C28—C29—C30 | −172.7 (5) |
| C1—C2—C3—C4 | 178.1 (8) | C28—C29—C30—C31 | −2.5 (10) |
| C7—C2—C3—C4 | 0.4 (10) | C29—C30—C31—C32 | 1.4 (10) |
| C2—C3—C4—C5 | 1.8 (14) | C30—C31—C32—C33 | 0.1 (9) |
| C3—C4—C5—C6 | −2.3 (15) | C29—C28—C33—C32 | −0.7 (7) |
| C4—C5—C6—C7 | 0.5 (12) | P1—C28—C33—C32 | 174.4 (4) |
| N1—N2—C7—C6 | −179.3 (6) | C31—C32—C33—C28 | −0.4 (8) |
| B1—N2—C7—C6 | 3.8 (9) | C22—P1—C34—C39 | −71.4 (5) |
| N1—N2—C7—C2 | −0.6 (6) | C28—P1—C34—C39 | 38.3 (5) |
| B1—N2—C7—C2 | −177.5 (5) | Ag1—P1—C34—C39 | 156.6 (4) |
| C5—C6—C7—N2 | −179.8 (6) | C22—P1—C34—C35 | 111.5 (4) |
| C5—C6—C7—C2 | 1.7 (9) | C28—P1—C34—C35 | −138.7 (4) |
| C1—C2—C7—N2 | 0.6 (6) | Ag1—P1—C34—C35 | −20.5 (4) |
| C3—C2—C7—N2 | 179.0 (5) | C39—C34—C35—C36 | 0.1 (8) |
| C1—C2—C7—C6 | 179.4 (5) | P1—C34—C35—C36 | 177.3 (4) |
| C3—C2—C7—C6 | −2.2 (9) | C34—C35—C36—C37 | −0.3 (9) |
| N4—N3—C8—C9 | 1.1 (6) | C35—C36—C37—C38 | 0.2 (10) |
| Ag1—N3—C8—C9 | −168.2 (3) | C36—C37—C38—C39 | 0.1 (10) |
| N3—C8—C9—C14 | −0.2 (6) | C37—C38—C39—C34 | −0.3 (9) |
| N3—C8—C9—C10 | 179.2 (6) | C35—C34—C39—C38 | 0.2 (8) |
| C14—C9—C10—C11 | 0.8 (8) | P1—C34—C39—C38 | −176.9 (4) |
| C8—C9—C10—C11 | −178.6 (6) | N3—N4—B1—N2 | −59.2 (6) |
| C9—C10—C11—C12 | −0.1 (9) | C14—N4—B1—N2 | 128.3 (5) |
| C10—C11—C12—C13 | −0.7 (10) | N3—N4—B1—N6 | 66.0 (5) |
| C11—C12—C13—C14 | 0.8 (9) | C14—N4—B1—N6 | −106.5 (5) |
| N3—N4—C14—C9 | 1.5 (5) | N1—N2—B1—N4 | 62.3 (6) |
| B1—N4—C14—C9 | 174.7 (5) | C7—N2—B1—N4 | −121.2 (5) |
| N3—N4—C14—C13 | −178.2 (5) | N1—N2—B1—N6 | −61.5 (6) |
| B1—N4—C14—C13 | −5.0 (8) | C7—N2—B1—N6 | 115.1 (5) |
| C8—C9—C14—N4 | −0.8 (5) | N5—N6—B1—N4 | −61.8 (5) |
| C10—C9—C14—N4 | 179.7 (4) | C21—N6—B1—N4 | 107.6 (5) |
| C8—C9—C14—C13 | 178.9 (4) | N5—N6—B1—N2 | 64.5 (6) |
| C10—C9—C14—C13 | −0.6 (7) | C21—N6—B1—N2 | −126.1 (5) |
Footnotes
Supplementary data and figures for this paper are available from the IUCr electronic archives (Reference: TK2225).
References
- Barbour, L. J. (2001). J. Supramol. Chem.1, 189–191.
- Higashi, T. (1995). ABSCOR Rigaku Corporation, Tokyo, Japan.
- Janiak, C., Temizdemir, S. & Dechert, S. (2000). Inorg. Chem. Commun.3, 271–275.
- Rigaku Corporation (1998). RAPID-AUTO Rigaku Corporation, Tokyo, Japan.
- Rigaku/MSC (2002). CrystalStructure Rigaku/MSC Inc. The Woodlands, Texas, USA.
- Sheldrick, G. M. (1997). SHELXS97 and SHELXL97 University of Göttingen, Germany.
- Westrip, S. P. (2007). publCIF In preparation.
Associated Data
This section collects any data citations, data availability statements, or supplementary materials included in this article.
Supplementary Materials
Crystal structure: contains datablocks global, I. DOI: 10.1107/S1600536807064239/tk2225sup1.cif
Structure factors: contains datablocks I. DOI: 10.1107/S1600536807064239/tk2225Isup2.hkl
Additional supplementary materials: crystallographic information; 3D view; checkCIF report

