Crystallography Open Database

Information card for entry 4308503

Preview

Coordinates	4308503.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H20 N2 Ni O9
Calculated formula	C12 H20 N2 Ni O9
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	10.4815 ± 0.0002 Å
b	20.0601 ± 0.0004 Å
c	8.1266 ± 0.0002 Å
α	90°
β	102.633 ± 0.009°
γ	90°
Cell volume	1667.33 ± 0.09 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0366
Residual factor for significantly intense reflections	0.0268
Weighted residual factors for significantly intense reflections	0.0544
Weighted residual factors for all reflections included in the refinement	0.0562
Goodness-of-fit parameter for all reflections included in the refinement	0.959
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.	4308503.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4308503.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4308503.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).	4308503.cif