Crystallography Open Database

Information card for entry 4512257

Preview

Coordinates	4512257.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H22 N4.5 Na0.5 O7.5 Zn
Calculated formula	C18 H20 N4.5 Na0.5 O7.5 Zn
Title of publication	Homochiral Layered Coordination Polymers from ChiralN-Carbamylglutamate and Achiral Flexible Bis(pyridine) Ligands: Syntheses, Crystal Structures, and Properties
Authors of publication	Wen, Yuehong; Sheng, Tianlu; Xue, Zhenzhen; Sun, Zhihao; Wang, Yanlong; Hu, Shengmin; Huang, Yihui; Li, Jie; Wu, Xintao
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	12
Pages of publication	6230
a	9.483 ± 0.003 Å
b	17.454 ± 0.006 Å
c	13.003 ± 0.004 Å
α	90°
β	99.291 ± 0.005°
γ	90°
Cell volume	2124 ± 1.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0732
Residual factor for significantly intense reflections	0.0478
Weighted residual factors for significantly intense reflections	0.0963
Weighted residual factors for all reflections included in the refinement	0.1089
Goodness-of-fit parameter for all reflections included in the refinement	0.998
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
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.	4512257.cif
131332	2015-02-07	cif/ Updating files of 4512255, 4512256, 4512257, 4512258 Original log message: Adding full bibliography for 4512255--4512258.cif.	4512257.cif
126605	2014-11-07	cif/ Adding structures of 4512255, 4512256, 4512257, 4512258 via cif-deposit CGI script.	4512257.cif