Crystallography Open Database

Information card for entry 4503209

Preview

Coordinates	4503209.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H22 Co N4 O6
Calculated formula	C21 H22 Co N4 O6
Title of publication	Hydrothermal Synthesis of Metal−Organic Frameworks Based on Aromatic Polycarboxylate and Flexible Bis(imidazole) Ligands
Authors of publication	Qi, Yan; Luo, Feng; Che, Yunxia; Zheng, Jimin
Journal of publication	Crystal Growth & Design
Year of publication	2008
Journal volume	8
Journal issue	2
Pages of publication	606
a	8.2544 ± 0.0017 Å
b	10.044 ± 0.002 Å
c	12.819 ± 0.003 Å
α	96.61 ± 0.03°
β	102.07 ± 0.03°
γ	90.54 ± 0.03°
Cell volume	1031.8 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0628
Residual factor for significantly intense reflections	0.044
Weighted residual factors for significantly intense reflections	0.0974
Weighted residual factors for all reflections included in the refinement	0.1062
Goodness-of-fit parameter for all reflections included in the refinement	1.016
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
179563 (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 4/50/32.	4503209.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4503209.cif
41414	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4503209 via cif-deposit CGI script.	4503209.cif