Crystallography Open Database

Information card for entry 4308500

Preview

Coordinates	4308500.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Mn-formate-Bipyridine
Formula	C12 H10 Mn N2 O4
Calculated formula	C12 H10 Mn N2 O4
Title of publication	Formate The Analogue of Azide: Structural and Magnetic Properties of M(HCOO)2(4,4'-bpy).nH2O (M = Mn, Co, Ni; n= 0, 5)
Authors of publication	Xin-Yi Wang; Hai-Yan Wei; Zhe-Ming Wang; Zhi-Da Chen; Song Gao
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	572 - 583
a	8.1469 ± 0.0002 Å
b	8.1469 ± 0.0002 Å
c	17.8046 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	1181.73 ± 0.05 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	92
Hermann-Mauguin space group symbol	P 41 21 2
Hall space group symbol	P 4abw 2nw
Residual factor for all reflections	0.0375
Residual factor for significantly intense reflections	0.0243
Weighted residual factors for significantly intense reflections	0.0458
Weighted residual factors for all reflections included in the refinement	0.0473
Goodness-of-fit parameter for all reflections included in the refinement	0.961
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
179123 (current)	2016-03-23	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/85.	4308500.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4308500.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4308500.cif
1526	2010-09-26	cif/4/ Adding new CIFs from Inorg. Chem. 2005 deposited via Web deposition site to the COD test database (and transferede to the main COD database after renaming).	4308500.cif