Crystallography Open Database

Information card for entry 4500202

Preview

Coordinates	4500202.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H22 F6 N4 O4 Zn
Calculated formula	C31 H22 F6 N4 O4 Zn
Title of publication	Effect of Different Imidazole Ancillary Ligands on Supramolecular Architectures of a Series of Zn(II) and Cd(II) Complexes with a Bent Dicarboxylate Ligand
Authors of publication	Ji, Chang-Chun; Qin, Ling; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen
Journal of publication	Crystal Growth & Design
Year of publication	2011
Journal volume	11
Journal issue	2
Pages of publication	480
a	13.001 ± 0.003 Å
b	26.347 ± 0.006 Å
c	13.131 ± 0.003 Å
α	90°
β	117.311 ± 0.004°
γ	90°
Cell volume	3996.5 ± 1.6 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0793
Residual factor for significantly intense reflections	0.0437
Weighted residual factors for significantly intense reflections	0.0894
Weighted residual factors for all reflections included in the refinement	0.0997
Goodness-of-fit parameter for all reflections included in the refinement	1.069
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
179533 (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 4/50/02.	4500202.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4500202.cif
34401	2012-02-25	../uploads/cif-deposit/cod/cif Adding structures of 4500202, 4500203, 4500204, 4500205, 4500206 via cif-deposit CGI script.	4500202.cif