Crystallography Open Database

Information card for entry 4509761

Preview

Coordinates	4509761.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H35 Co1.5 N4 O13
Calculated formula	C35 H35 Co1.5 N4 O13
Title of publication	Co(II) Metal−Organic Frameworks (MOFs) Assembled from Asymmetric Semirigid Multicarboxylate Ligands: Synthesis, Crystal Structures, and Magnetic Properties
Authors of publication	Wang, Hailong; Zhang, Daopeng; Sun, Daofeng; Chen, Yuting; Zhang, Li-Fang; Tian, Laijin; Jiang, Jianzhuang; Ni, Zhong-Hai
Journal of publication	Crystal Growth & Design
Year of publication	2009
Journal volume	9
Journal issue	12
Pages of publication	5273
a	9.3521 ± 0.0009 Å
b	11.3471 ± 0.0012 Å
c	18.8078 ± 0.0018 Å
α	79.46 ± 0.002°
β	79.462 ± 0.002°
γ	66.512 ± 0.002°
Cell volume	1786.2 ± 0.3 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0829
Residual factor for significantly intense reflections	0.0487
Weighted residual factors for significantly intense reflections	0.1117
Weighted residual factors for all reflections included in the refinement	0.1234
Goodness-of-fit parameter for all reflections included in the refinement	0.997
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.	4509761.cif
97479	2014-01-29	cif/ Adding structures of 4509758, 4509759, 4509760, 4509761 via cif-deposit CGI script.	4509761.cif