Crystallography Open Database

Information card for entry 7210352

Preview

Coordinates	7210352.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H53 Cd N6 O11
Calculated formula	C42 H53 Cd N6 O11
Title of publication	Structure-directing roles of auxiliary polycarboxylate ligands in the formation of Zn(ii) and Cd(ii) coordination polymers based on a flexible N,N′-di(3-pyridyl)dodecanediamide
Authors of publication	Cheng, Pei-Chi; Kuo, Po-Ting; Xie, Ming-Yuan; Hsu, Wayne; Chen, Jhy-Der
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	31
Pages of publication	6264
a	9.7935 ± 0.0004 Å
b	12.1729 ± 0.0006 Å
c	18.9627 ± 0.0009 Å
α	78.802 ± 0.003°
β	89.871 ± 0.003°
γ	70.511 ± 0.003°
Cell volume	2085.76 ± 0.17 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0599
Residual factor for significantly intense reflections	0.0404
Weighted residual factors for significantly intense reflections	0.0783
Weighted residual factors for all reflections included in the refinement	0.0857
Goodness-of-fit parameter for all reflections included in the refinement	1.05
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
180434 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/03.	7210352.cif
87604	2013-08-27	cif/ Adding structures of 7210348, 7210349, 7210350, 7210351, 7210352 via cif-deposit CGI script.	7210352.cif