Crystallography Open Database

Information card for entry 4503321

Preview

Coordinates	4503321.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H31 Cd N6 O10.5
Calculated formula	C40 H31 Cd N6 O10.5
Title of publication	Structures and Luminescent Properties of a Series of Zinc(II) and Cadmium(II) 4,4′-Oxydiphthalate Coordination Polymers with Various Ligands Based on Bis(pyridyl imidazole) under Hydrothermal Conditions
Authors of publication	Li, Shun-Li; Lan, Ya-Qian; Ma, Jian-Fang; Fu, Yao-Mei; Yang, Jin; Ping, Guang-Ju; Liu, Jie; Su, Zhong-Min
Journal of publication	Crystal Growth & Design
Year of publication	2008
Journal volume	8
Journal issue	5
Pages of publication	1610
a	11.312 ± 0.0008 Å
b	20.119 ± 0.0013 Å
c	16.13 ± 0.0015 Å
α	90°
β	96.52 ± 0.001°
γ	90°
Cell volume	3647.2 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0896
Residual factor for significantly intense reflections	0.0551
Weighted residual factors for significantly intense reflections	0.1505
Weighted residual factors for all reflections included in the refinement	0.1753
Goodness-of-fit parameter for all reflections included in the refinement	1.058
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4503321.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4503321.cif
41485	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4503317, 4503318, 4503319, 4503320, 4503321, 4503322 via cif-deposit CGI script.	4503321.cif