Crystallography Open Database

Information card for entry 7239195

Preview

Coordinates	7239195.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H27 Br2 Cd3 N8 S6
Calculated formula	C19 H26 Br2 Cd3 N8 S6
Title of publication	New halo(pseudohalo)cadmates templated by protonatated N-heterocyclic/diamine molecules
Authors of publication	Jia, Hong-Li; Li, Guang-Hua; Ding, Hong; Gao, Zhong-Min; Zeng, Guang; Yu, Jie-Hui; Xu, Ji-Qing
Journal of publication	RSC Advances
Year of publication	2013
Journal volume	3
Journal issue	37
Pages of publication	16416
a	28.015 ± 0.002 Å
b	5.9167 ± 0.0003 Å
c	21.764 ± 0.0018 Å
α	90°
β	113.306 ± 0.008°
γ	90°
Cell volume	3313.2 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0429
Residual factor for significantly intense reflections	0.035
Weighted residual factors for significantly intense reflections	0.0823
Weighted residual factors for all reflections included in the refinement	0.0858
Goodness-of-fit parameter for all reflections included in the refinement	1.041
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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