Crystallography Open Database

Information card for entry 4507249

Preview

Coordinates	4507249.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H21 Cd2 N O12
Calculated formula	C21 H21 Cd2 N O12
Title of publication	Structure Versatility of Coordination Polymers Constructed from a Semirigid Tetracarboxylate Ligand: Syntheses, Structures, and Photoluminescent Properties
Authors of publication	Lin, Zu-Jin; Han, Li-Wei; Wu, Dong-Shuang; Huang, Yuan-Biao; Cao, Rong
Journal of publication	Crystal Growth & Design
Year of publication	2013
Journal volume	13
Journal issue	1
Pages of publication	255
a	14.271 ± 0.003 Å
b	14.432 ± 0.003 Å
c	22.549 ± 0.005 Å
α	90°
β	99.86 ± 0.03°
γ	90°
Cell volume	4575.6 ± 1.7 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.05
Residual factor for significantly intense reflections	0.0455
Weighted residual factors for significantly intense reflections	0.1359
Weighted residual factors for all reflections included in the refinement	0.1391
Goodness-of-fit parameter for all reflections included in the refinement	1.092
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
179608 (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 4/50/72.	4507249.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4507249.cif
73866	2013-02-21	cif/ Adding structures of 4507246, 4507247, 4507248, 4507249, 4507250, 4507251, 4507252, 4507253, 4507254, 4507255, 4507256, 4507257 via cif-deposit CGI script.	4507249.cif