Crystallography Open Database

Information card for entry 4512137

Preview

Coordinates	4512137.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H41 Cd2 N7 O18
Calculated formula	C39 H40.9 Cd2 N7 O17.9
Title of publication	Series of Cd(II) and Pb(II) Coordination Polymers Based on a Multilinker (R,S-)2,2′-Bipyridine-3,3′-dicarboxylate-1,1′-dioxide
Authors of publication	Kang, Yi-Fan; Liu, Jian-Qiang; Liu, Bo; Zhang, Wen-Tao; Liu, Qing; Liu, Ping; Wang, Yao-Yu
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	11
Pages of publication	5466
a	24.542 ± 0.004 Å
b	12.641 ± 0.002 Å
c	15.446 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	4791.9 ± 1.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.079
Residual factor for significantly intense reflections	0.0587
Weighted residual factors for significantly intense reflections	0.1642
Weighted residual factors for all reflections included in the refinement	0.1795
Goodness-of-fit parameter for all reflections included in the refinement	1.038
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
179668 (current)	2016-03-24	cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/21.	4512137.cif
126860	2014-11-11	cif/ Updating files of 4512136, 4512137, 4512138, 4512139, 4512140, 4512141 Original log message: Adding full bibliography for 4512136--4512141.cif.	4512137.cif
125215	2014-10-10	cif/ Adding structures of 4512137 via cif-deposit CGI script.	4512137.cif