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. 2019 Sep 12;75(Pt 10):1486–1489. doi: 10.1107/S2056989019012623

Table 4. Experimental details.

Crystal data
Chemical formula [Pt(C15H18N4O4S)(C2H6OS)]
M r 623.61
Crystal system, space group Triclinic, P Inline graphic
Temperature (K) 296
a, b, c (Å) 6.5264 (3), 8.9024 (3), 18.9261 (7)
α, β, γ (°) 82.228 (1), 87.074 (1), 74.739 (1)
V3) 1050.96 (7)
Z 2
Radiation type Mo Kα
μ (mm−1) 6.91
Crystal size (mm) 0.49 × 0.21 × 0.15
 
Data collection
Diffractometer Bruker APEX Duo CCD area detector
Absorption correction Multi-scan (SADABS; Bruker, 2012)
T min, T max 0.039, 0.092
No. of measured, independent and observed [I > 2σ(I)] reflections 41144, 6285, 5899
R int 0.030
(sin θ/λ)max−1) 0.711
 
Refinement
R[F 2 > 2σ(F 2)], wR(F 2), S 0.019, 0.042, 1.09
No. of reflections 6285
No. of parameters 269
H-atom treatment H atoms treated by a mixture of independent and constrained refinement
Δρmax, Δρmin (e Å−3) 0.98, −0.80

Computer programs: APEX2 and SAINT (Bruker, 2012), SHELXS97 (Sheldrick, 2008), Mercury (Macrae et al., 2008), SHELXL2013 (Sheldrick, 2015) and PLATON (Spek, 2009).