Crystallography Open Database

Information card for entry 7239196

Preview

Coordinates	7239196.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H26 Cd3 N12 O0 S8
Calculated formula	C20 H26 Cd3 N12 S8
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	9.7352 ± 0.0004 Å
b	12.262 ± 0.0007 Å
c	14.6609 ± 0.001 Å
α	90°
β	99.067 ± 0.004°
γ	90°
Cell volume	1728.25 ± 0.17 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.026
Residual factor for significantly intense reflections	0.0232
Weighted residual factors for significantly intense reflections	0.059
Weighted residual factors for all reflections included in the refinement	0.0619
Goodness-of-fit parameter for all reflections included in the refinement	1.122
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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