Crystallography Open Database

Information card for entry 4508180

Preview

Coordinates	4508180.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H44 Cd2 N18 O18
Calculated formula	C42 H44 Cd2 N18 O18
Title of publication	A Series of Coordination Polymers Constructed from a Multidentate N-Donor Ligand and Varied Carboxylate Anions: Syntheses, Structures, and Luminescent Properties
Authors of publication	Zhang, Zhe; Ma, Jian-Fang; Liu, Ying-Ying; Kan, Wei-Qiu; Yang, Jin
Journal of publication	Crystal Growth & Design
Year of publication	2013
Journal volume	13
Journal issue	10
Pages of publication	4338
a	13.395 ± 0.0005 Å
b	10.177 ± 0.0003 Å
c	17.662 ± 0.0009 Å
α	90°
β	96.925 ± 0.003°
γ	90°
Cell volume	2390.14 ± 0.17 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/n 1
Hall space group symbol	-P 2yac
Residual factor for all reflections	0.0433
Residual factor for significantly intense reflections	0.0345
Weighted residual factors for significantly intense reflections	0.0821
Weighted residual factors for all reflections included in the refinement	0.0893
Goodness-of-fit parameter for all reflections included in the refinement	1.034
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4508180.cif
88895	2013-10-09	cif/ Adding structures of 4508177, 4508178, 4508179, 4508180, 4508181, 4508182, 4508183, 4508184, 4508185, 4508186 via cif-deposit CGI script.	4508180.cif