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. 2019 Sep 12;75(Pt 10):1479–1485. doi: 10.1107/S2056989019012490

Table 6. Experimental details.

Crystal data
Chemical formula [Sn(C6H5)3(C7H14NS2)]
M r 526.30
Crystal system, space group Triclinic, P Inline graphic
Temperature (K) 100
a, b, c (Å) 9.7572 (1), 11.7030 (2), 11.7602 (2)
α, β, γ (°) 74.419 (1), 80.114 (1), 67.285 (2)
V3) 1189.71 (4)
Z 2
Radiation type Cu Kα
μ (mm−1) 10.25
Crystal size (mm) 0.12 × 0.11 × 0.08
 
Data collection
Diffractometer Rigaku XtaLAB Synergy Dualflex AtlasS2
Absorption correction Gaussian (CrysAlis PRO; Rigaku OD, 2018)
T min, T max 0.840, 1.000
No. of measured, independent and observed [I > 2σ(I)] reflections 28219, 4248, 4231
R int 0.022
(sin θ/λ)max−1) 0.597
 
Refinement
R[F 2 > 2σ(F 2)], wR(F 2), S 0.015, 0.040, 1.00
No. of reflections 4248
No. of parameters 266
H-atom treatment H-atom parameters constrained
Δρmax, Δρmin (e Å−3) 0.36, −0.44

Computer programs: CrysAlis PRO (Rigaku OD, 2018), SHELXS (Sheldrick, 2015a ), SHELXL2014 (Sheldrick, 2015b ), ORTEP-3 for Windows (Farrugia, 2012), DIAMOND (Brandenburg, 2006) and publCIF (Westrip, 2010).