Crystallography Open Database

Information card for entry 7213914

Preview

Coordinates	7213914.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H20 Mn N4 O5
Calculated formula	C23 H20 Mn N4 O5
Title of publication	Exploring the structural diversities and magnetic properties of copper(ii) and manganese(ii) complexes based on 5-methoxyisophthalate and flexible bis(imidazole) ligands
Authors of publication	Chang, Xin-Hong; Qin, Jian-Hua; Han, Min-Le; Ma, Lu-Fang; Wang, Li-Ya
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	5
Pages of publication	870
a	9.6214 ± 0.001 Å
b	10.068 ± 0.0011 Å
c	12.9326 ± 0.0014 Å
α	80.07 ± 0.001°
β	81.24 ± 0.001°
γ	62.315 ± 0.001°
Cell volume	1089 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 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	0.0442
Residual factor for significantly intense reflections	0.0353
Weighted residual factors for significantly intense reflections	0.0999
Weighted residual factors for all reflections included in the refinement	0.1071
Goodness-of-fit parameter for all reflections included in the refinement	1.042
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
180470 (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 7/21/39.	7213914.cif
105207	2014-03-11	cif/ Adding structures of 7213910, 7213911, 7213912, 7213913, 7213914, 7213915 via cif-deposit CGI script.	7213914.cif