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. 2015 Sep 26;71(Pt 10):1219–1221. doi: 10.1107/S2056989015017429

Table 2. Experimental details.

Crystal data
Chemical formula [Re2(C4H7O2)2Cl4(C2H6OS)2]
M r 844.65
Crystal system, space group Monoclinic, P21/n
Temperature (K) 110
a, b, c () 10.5581(4), 14.7406(5), 15.6088(6)
() 100.794(2)
V (3) 2386.26(15)
Z 4
Radiation type Mo K
(mm1) 10.78
Crystal size (mm) 0.22 0.18 0.09
 
Data collection
Diffractometer Siemens SMART CCD area-detector
Absorption correction Multi-scan (SADABS; Bruker, 2008)
T min, T max 0.133, 0.478
No. of measured, independent and observed [I > 2(I)] reflections 93039, 14497, 11921
R int 0.040
(sin /)max (1) 0.909
 
Refinement
R[F 2 > 2(F 2)], wR(F 2), S 0.025, 0.049, 1.00
No. of reflections 14497
No. of parameters 243
H-atom treatment H-atom parameters constrained
max, min (e 3) 1.71, 1.14

Computer programs: APEX2 and SAINT (Bruker, 2008), SHELXS97 (Sheldrick 2008), SHELXL2014 (Sheldrick, 2015), DIAMOND (Brandenburg, 1999) and WinGX (Farrugia, 2012).