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. 2023 Mar 9;79(Pt 4):118–124. doi: 10.1107/S2053229623001845

Table 1. Experimental details.

Crystal data
Chemical formula [NiPt2Cl6(C29H20NPSi)4]·5CH2Cl2·20C2H6O
M r 3773.65
Crystal system, space group Triclinic, P Inline graphic
Temperature (K) 100
a, b, c (Å) 12.702 (7), 19.372 (10), 20.340 (7)
α, β, γ (°) 71.313 (7), 81.809 (13), 78.917 (19)
V3) 4635 (4)
Z 1
Radiation type Synchrotron, λ = 0.500 Å
μ (mm−1) 0.78
Crystal size (mm) 0.20 × 0.20 × 0.10
 
Data collection
Diffractometer Area-detector Dectris CdTe on a κ goniometer at EH1 P24, DESY
Absorption correction Multi-scan (SADABS; Bruker, 2014)
T min, T max 0.775, 0.837
No. of measured, independent and observed [I > 2σ(I)] reflections 161591, 20869, 16117
R int 0.063
(sin θ/λ)max−1) 0.657
 
Refinement
R[F 2 > 2σ(F 2)], wR(F 2), S 0.036, 0.108, 1.03
No. of reflections 20869
No. of parameters 691
H-atom treatment H-atom parameters constrained
Δρmax, Δρmin (e Å−3) 1.58, −1.04

Computer programs: KAPPA (Paulmann, 2023), XDS2022 (Kabsch, 2010), SHELXT2018 (Sheldrick, 2015a ), SHELXL2018 (Sheldrick, 2015b ) and PLATON (Spek, 2020).