Crystallography Open Database

Information card for entry 7210442

Preview

Coordinates	7210442.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C13 H12 Cu N2 O8
Calculated formula	C13 H12 Cu N2 O8
Title of publication	1D, 2D and 3D coordination polymers of 5,5′-methylenebis(oxy)dinicotinic acid with Co(ii), Mn(ii), Cu(ii) and Cd(ii) ions
Authors of publication	Patra, Ranjan; Titi, Hatem M.; Goldberg, Israel
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	36
Pages of publication	7257
a	16.2119 ± 0.0004 Å
b	10.9173 ± 0.0003 Å
c	15.7225 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	2782.73 ± 0.12 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	5
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.0444
Residual factor for significantly intense reflections	0.0368
Weighted residual factors for significantly intense reflections	0.0922
Weighted residual factors for all reflections included in the refinement	0.0965
Goodness-of-fit parameter for all reflections included in the refinement	1.014
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
180435 (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 7/21/04.	7210442.cif
87626	2013-08-27	cif/ Adding structures of 7210441, 7210442, 7210443, 7210444, 7210445, 7210446, 7210447 via cif-deposit CGI script.	7210442.cif