Crystallography Open Database

Information card for entry 7208651

7208650 << 7208651 >> 7208652

Preview

Coordinates	7208651.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H19 Cd2 N3 O8
Calculated formula	C27 H19 Cd2 N3 O8
Title of publication	Syntheses, crystal structures and properties of transition metal coordination polymers based on isophthalic acid and flexible bis(pyridyl) ligand with unsymmetrical spacer: influence of metal cations, ligand conformations and coordination modes
Authors of publication	Deng, Zhao-Peng; Zhang, Zhu-Yan; Huo, Li-Hua; Ng, Seik Weng; Zhao, Hui; Gao, Shan
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	20
Pages of publication	6548
a	12.055 ± 0.002 Å
b	13.112 ± 0.003 Å
c	16.94 ± 0.003 Å
α	90°
β	107.21 ± 0.03°
γ	90°
Cell volume	2557.7 ± 0.9 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	5
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	0.0542
Residual factor for significantly intense reflections	0.0476
Weighted residual factors for significantly intense reflections	0.1302
Weighted residual factors for all reflections included in the refinement	0.1349
Goodness-of-fit parameter for all reflections included in the refinement	1.09
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	7208651.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7208651.cif
71444	2013-01-20	cif/ Adding structures of 7208648, 7208649, 7208650, 7208651, 7208652, 7208653, 7208654, 7208655 via cif-deposit CGI script.	7208651.cif