Crystallography Open Database

Information card for entry 4506513

Preview

Coordinates	4506513.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H16 Cd1.5 N O7
Calculated formula	C19 H16 Cd1.5 N O7
Title of publication	Solvent-Dependent Formation of Cd(II) Coordination Polymers Based on aC2-Symmetric Tricarboxylate Linker
Authors of publication	Li, Lina; Wang, Shuyun; Chen, Tianliang; Sun, Zhihua; Luo, Junhua; Hong, Maochun
Journal of publication	Crystal Growth & Design
Year of publication	2012
Journal volume	12
Journal issue	8
Pages of publication	4109
a	19.9999 ± 0.0017 Å
b	10.0714 ± 0.0006 Å
c	18.942 ± 0.0017 Å
α	90°
β	101.196 ± 0.006°
γ	90°
Cell volume	3742.8 ± 0.5 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	0.068
Residual factor for significantly intense reflections	0.0523
Weighted residual factors for significantly intense reflections	0.1453
Weighted residual factors for all reflections included in the refinement	0.1619
Goodness-of-fit parameter for all reflections included in the refinement	1.055
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
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.	4506513.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4506513.cif
66200	2012-09-09	cif/ Adding structures of 4506513 via cif-deposit CGI script.	4506513.cif