Crystallography Open Database

Information card for entry 7215321

Preview

Coordinates	7215321.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H20 Cd3 Cl3 N11 O2
Calculated formula	C12 H20 Cd3 Cl3 N11 O2
Title of publication	Role of molar-ratio, temperature and solvent on the Zn/Cd 1,2,4-triazolate system with novel topological architectures
Authors of publication	Yin, Pei-Xiu; Zhang, Jian; Qin, Ye-Yan; Cheng, Jian-Kai; Li, Zhao-Ji; Yao, Yuan-Gen
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	10
Pages of publication	3536
a	11.856 ± 0.008 Å
b	12.019 ± 0.008 Å
c	16.688 ± 0.012 Å
α	90°
β	90°
γ	90°
Cell volume	2378 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	36
Hermann-Mauguin space group symbol	C m c 21
Hall space group symbol	C 2c -2
Residual factor for all reflections	0.0463
Residual factor for significantly intense reflections	0.0418
Weighted residual factors for significantly intense reflections	0.0929
Weighted residual factors for all reflections included in the refinement	0.0956
Goodness-of-fit parameter for all reflections included in the refinement	1.072
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180484 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/53.	7215321.cif
111917	2014-04-28	cif/ Adding structures of 7215319, 7215320, 7215321, 7215322, 7215323 via cif-deposit CGI script.	7215321.cif