Crystallography Open Database

Information card for entry 4502518

Preview

Coordinates	4502518.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16.5 H18 Cd N4 O6
Calculated formula	C16.5 H18 Cd N4 O6
Title of publication	Effect of Anions on the Self-Assembly of Cd(II)-Containing Coordination Polymers Based on a Novel Flexible Tetrakis(imidazole) Ligand
Authors of publication	Bai, Hong-Ye; Ma, Jian-Fang; Yang, Jin; Liu, Ying-Ying; Hua-Wu,; Ma, Ji-Cheng
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	2
Pages of publication	995
a	22.605 ± 0.008 Å
b	11.491 ± 0.0018 Å
c	17.511 ± 0.012 Å
α	90°
β	124.65 ± 0.014°
γ	90°
Cell volume	3742 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.098
Residual factor for significantly intense reflections	0.0417
Weighted residual factors for significantly intense reflections	0.0563
Weighted residual factors for all reflections included in the refinement	0.0615
Goodness-of-fit parameter for all reflections included in the refinement	0.836
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4502518.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4502518.cif
36450	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4502511, 4502512, 4502513, 4502514, 4502515, 4502516, 4502517, 4502518, 4502519, 4502520, 4502521, 4502522, 4502523, 4502524 via cif-deposit CGI script.	4502518.cif