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. 2016 Mar 11;72(Pt 4):489–491. doi: 10.1107/S2056989016003996

Table 2. Experimental details.

Crystal data
Chemical formula [Cr2Pb2(NCS)2(OH)2(C4H10NO)4](NCS)2·C2H3N
M r 1178.29
Crystal system, space group Monoclinic, C2/c
Temperature (K) 298
a, b, c (Å) 17.533 (1), 13.8815 (7), 16.6179 (8)
β (°) 104.771 (6)
V3) 3910.9 (4)
Z 4
Radiation type Mo Kα
μ (mm−1) 9.39
Crystal size (mm) 0.4 × 0.1 × 0.1
 
Data collection
Diffractometer Agilent Xcalibur Sapphire 3
Absorption correction Multi-scan (CrysAlis PRO; Agilent, 2011)
T min, T max 0.382, 1.000
No. of measured, independent and observed [I > 2σ(I)] reflections 20193, 5680, 4133
R int 0.064
(sin θ/λ)max−1) 0.703
 
Refinement
R[F 2 > 2σ(F 2)], wR(F 2), S 0.035, 0.058, 0.93
No. of reflections 5680
No. of parameters 190
H-atom treatment H-atom parameters constrained
Δρmax, Δρmin (e Å−3) 1.00, −0.69

Computer programs: CrysAlis PRO (Agilent, 2011), SHELXS97 and SHELXL97 (Sheldrick, 2008), OLEX2 (Dolomanov et al., 2009) and PLATON (Spek, 2009).