Crystallography Open Database

Information card for entry 4503101

Preview

Coordinates	4503101.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C63 H91 Cd2 Ce3 N9 O67
Calculated formula	C63 H67 Cd2 Ce3 N9 O67
Title of publication	Solvent Dependent Crystallization of Isomeric Chain Coordination Polymers in the Ce-Zn/Cd-dipic System
Authors of publication	Prasad, T. K.; Rajasekharan, M. V.
Journal of publication	Crystal Growth & Design
Year of publication	2008
Journal volume	8
Journal issue	4
Pages of publication	1346
a	13.41 ± 0.0009 Å
b	10.5921 ± 0.0007 Å
c	34.73 ± 0.002 Å
α	90°
β	94.364 ± 0.001°
γ	90°
Cell volume	4918.7 ± 0.5 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
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	0.053
Residual factor for significantly intense reflections	0.0477
Weighted residual factors for significantly intense reflections	0.1327
Weighted residual factors for all reflections included in the refinement	0.1369
Goodness-of-fit parameter for all reflections included in the refinement	1.044
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
179562 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/31.	4503101.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4503101.cif
41350	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4503098, 4503099, 4503100, 4503101, 4503102, 4503103 via cif-deposit CGI script.	4503101.cif