Crystallography Open Database

Information card for entry 1562950

Preview

Coordinates	1562950.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Tetra(aqua)(fumarato)cobalt(II) monohydrate
Formula	C4 H12 Co O9
Calculated formula	C4 H12 Co O9
SMILES	[Co]([OH2])([OH2])(OC(=O)/C=C/C(=O)[O-])([OH2])([OH2])OC(=O)/C=C/C(=O)O[Co]([OH2])([OH2])([OH2])[OH2].O.O
Title of publication	Synthesis and properties of a few 1-D cobaltous fumarates
Authors of publication	Bora, Sanchay J.; Das, Birinchi K.
Journal of publication	Journal of Solid State Chemistry
Year of publication	2012
Journal volume	192
Pages of publication	93 - 101
a	5.2931 ± 0.0009 Å
b	13.209 ± 0.002 Å
c	13.346 ± 0.002 Å
α	90°
β	95.26 ± 0.003°
γ	90°
Cell volume	929.2 ± 0.3 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0274
Residual factor for significantly intense reflections	0.027
Weighted residual factors for significantly intense reflections	0.0749
Weighted residual factors for all reflections included in the refinement	0.0752
Goodness-of-fit parameter for all reflections included in the refinement	1.074
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
265580 (current)	2021-05-28	cif/ Adding structures of 1562950, 1562951, 1562952 via cif-deposit CGI script.	1562950.cif