Crystallography Open Database

Information card for entry 7215789

Preview

Coordinates	7215789.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H14 Br4 Co2 N4 O9
Calculated formula	C24 H14 Br4 Co2 N4 O9
Title of publication	Synthesis, structure, topology and magnetic properties of new coordination polymers based on 5(‒Br/‒COOH)-substituted nicotinic acid
Authors of publication	Nandi, Goutam; Thakuria, Ranjit; Titi, Hatem M.; Patra, Ranjan; Goldberg, Israel
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	24
Pages of publication	5244
a	14.2109 ± 0.0005 Å
b	17.6868 ± 0.0006 Å
c	14.211 ± 0.0005 Å
α	90°
β	118.306 ± 0.002°
γ	90°
Cell volume	3144.8 ± 0.2 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 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	0.0463
Residual factor for significantly intense reflections	0.0373
Weighted residual factors for significantly intense reflections	0.1034
Weighted residual factors for all reflections included in the refinement	0.1068
Goodness-of-fit parameter for all reflections included in the refinement	1.089
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
180488 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/57.	7215789.cif
116172	2014-06-07	cif/ Updating files of 7215786, 7215787, 7215788, 7215789, 7215790, 7215791, 7215792, 7215793, 7215794 Original log message: Adding full bibliography for 7215786--7215794.cif.	7215789.cif
113253	2014-05-09	cif/ Adding structures of 7215786, 7215787, 7215788, 7215789, 7215790, 7215791, 7215792, 7215793, 7215794 via cif-deposit CGI script.	7215789.cif