Crystallography Open Database

Information card for entry 7209858

7209857 << 7209858 >> 7209859

Preview

Coordinates	7209858.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H9 Cd N6 O7
Calculated formula	C15 H9 Cd N6 O7
Title of publication	Cadmium(ii) and zinc(ii) complexes with rigid 1-(1H-imidazol-4-yl)-3-(4H-tetrazol-5-yl)benzene and varied carboxylate ligands
Authors of publication	Chen, Shui-Sheng; Qiao, Rui; Sheng, Liang-Quan; Zhao, Yue; Yang, Song; Chen, Ming-Ming; Liu, Zhao-Di; Wang, Dei-Hai
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	28
Pages of publication	5713
a	7.6227 ± 0.0004 Å
b	10.5639 ± 0.0005 Å
c	12.0613 ± 0.0006 Å
α	68.254 ± 0.001°
β	84.76 ± 0.001°
γ	76.642 ± 0.001°
Cell volume	877.7 ± 0.08 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0322
Residual factor for significantly intense reflections	0.0265
Weighted residual factors for significantly intense reflections	0.0875
Weighted residual factors for all reflections included in the refinement	0.1133
Goodness-of-fit parameter for all reflections included in the refinement	1.038
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
180429 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/98.	7209858.cif
86868	2013-07-12	cif/ Adding structures of 7209855, 7209856, 7209857, 7209858, 7209859, 7209860 via cif-deposit CGI script.	7209858.cif