Crystallography Open Database

Information card for entry 7062929

Preview

Coordinates	7062929.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Manganese hydroxide vanadate divanadate
Chemical name	Hexamanganese manganese trihydroxide dihydrogen/hydrogenvanadate divanadate
Formula	H4.2 Mn6.75 O18.845 V4
Calculated formula	H4.2 Mn6.749 O18.847 V4
Title of publication	Crystal structure, infrared spectroscopy and thermodynamic properties of a manganese member of the ellenbergerite family
Authors of publication	Shvanskaya, Larisa V.; Krikunova, Polina V.; Vasilchikova, Tatyana M.; Borovikova, Elena Y.; Volkova, Olga S.; Vasiliev, Alexander N.
Journal of publication	New Journal of Chemistry
Year of publication	2024
Journal volume	48
Journal issue	5
Pages of publication	1952 - 1957
a	13.1893 ± 0.0005 Å
b	13.1893 ± 0.0005 Å
c	5.2408 ± 0.0002 Å
α	90°
β	90°
γ	120°
Cell volume	789.54 ± 0.05 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	4
Space group number	186
Hermann-Mauguin space group symbol	P 63 m c
Hall space group symbol	P 6c -2c
Residual factor for all reflections	0.0199
Residual factor for significantly intense reflections	0.018
Weighted residual factors for significantly intense reflections	0.0393
Weighted residual factors for all reflections included in the refinement	0.04
Goodness-of-fit parameter for all reflections included in the refinement	1.078
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
289584 (current)	2024-02-04	cif/ Updating files of 7062929 Original log message: Adding full bibliography for 7062929.cif.	7062929.cif
288519	2023-12-23	cif/ Adding structures of 7062929 via cif-deposit CGI script.	7062929.cif