Crystallography Open Database

Information card for entry 7015272

Preview

Coordinates	7015272.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H15 Cl2 Co N4 O14
Calculated formula	C6 H15 Cl2 Co N4 O14
Title of publication	Structural and magnetic properties of three novel complexes with the versatile ligand 5-methyl-1,2,4-triazolo[1,5-a]pyrimidin-7(4H)-one.
Authors of publication	Caballero, Ana B.; Rodríguez-Diéguez, Antonio; Lezama, Luis; Barea, Elisa; Salas, Juan M.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2011
Journal volume	40
Journal issue	19
Pages of publication	5180 - 5187
a	12.923 ± 0.005 Å
b	6.542 ± 0.005 Å
c	10.446 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	883.1 ± 0.9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	31
Hermann-Mauguin space group symbol	P m n 21
Hall space group symbol	P 2ac -2
Residual factor for all reflections	0.0588
Residual factor for significantly intense reflections	0.0536
Weighted residual factors for significantly intense reflections	0.1456
Weighted residual factors for all reflections included in the refinement	0.1504
Goodness-of-fit parameter for all reflections included in the refinement	1.074
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179856 (current)	2016-03-25	cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/52.	7015272.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7015272.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7015272.cif
21108	2011-06-21	../uploads/cif-deposit/cod/cif Adding structures of 7015270, 7015271, 7015272 via cif-deposit CGI script.	7015272.cif