Crystallography Open Database

Information card for entry 4508178

Preview

Coordinates	4508178.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H44 N18 O18 Zn2
Calculated formula	C42 H40 N18 O18 Zn2
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	13.286 ± 0.0009 Å
b	10.024 ± 0.0005 Å
c	17.437 ± 0.001 Å
α	90°
β	98.758 ± 0.005°
γ	90°
Cell volume	2295.2 ± 0.2 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	0.1235
Residual factor for significantly intense reflections	0.0647
Weighted residual factors for significantly intense reflections	0.1071
Weighted residual factors for all reflections included in the refinement	0.1274
Goodness-of-fit parameter for all reflections included in the refinement	1.021
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.	4508178.cif
88895	2013-10-09	cif/ Adding structures of 4508177, 4508178, 4508179, 4508180, 4508181, 4508182, 4508183, 4508184, 4508185, 4508186 via cif-deposit CGI script.	4508178.cif