Crystallography Open Database

Information card for entry 4338267

Preview

Coordinates	4338267.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C4 H8 Mn N2 O6
Calculated formula	C4 H7 Mn N2 O6
Title of publication	Perovskite Metal Formate Framework of [NH2-CH(+)-NH2]Mn(HCOO)3]: Phase Transition, Magnetic, Dielectric, and Phonon Properties.
Authors of publication	Mączka, Mirosław; Ciupa, Aneta; Gągor, Anna; Sieradzki, Adam; Pikul, Adam; Macalik, Bogusław; Drozd, Marek
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	10
Pages of publication	5260 - 5268
a	13.8035 ± 0.0007 Å
b	8.6913 ± 0.0004 Å
c	8.4626 ± 0.0004 Å
α	90°
β	119.664 ± 0.004°
γ	90°
Cell volume	882.2 ± 0.08 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	5
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	0.0323
Residual factor for significantly intense reflections	0.0274
Weighted residual factors for significantly intense reflections	0.0727
Weighted residual factors for all reflections included in the refinement	0.0758
Goodness-of-fit parameter for all reflections included in the refinement	1.086
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
179485 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/82.	4338267.cif
115681	2014-06-05	cif/ Updating files of 4338266, 4338267, 4338268 Original log message: Adding full bibliography for 4338266--4338268.cif.	4338267.cif
112331	2014-05-01	cif/ Adding structures of 4338267 via cif-deposit CGI script.	4338267.cif