Crystallography Open Database

Information card for entry 7229642

Preview

Coordinates	7229642.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	potassium manganese(II) oxalatophosphite
Formula	C2 H6 K2 Mn2 O12 P2
Calculated formula	C2 H6 K2 Mn2 O12 P2
Title of publication	K2MnII2(H2O)2C2O4(HPO3)2: a new 2D manganese(ii) oxalatophosphite with double-layered honeycomb sheets stabilized by potassium ions
Authors of publication	Orive, Joseba; Sivasamy, Ramesh; Fernández de Luis, Roberto; Mosquera, Edgar; Arriortua, María I.
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	3
Pages of publication	301
a	9.7371 ± 0.0002 Å
b	9.7371 ± 0.0002 Å
c	22.4924 ± 0.0005 Å
α	90°
β	90°
γ	120°
Cell volume	1846.82 ± 0.07 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor for all reflections	0.0259
Residual factor for significantly intense reflections	0.0241
Weighted residual factors for significantly intense reflections	0.0529
Weighted residual factors for all reflections included in the refinement	0.054
Goodness-of-fit parameter for all reflections included in the refinement	1.053
Diffraction radiation probe	x-ray
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
229160 (current)	2019-11-17	cif/ Updating files of 7229642 Original log message: Adding full bibliography for 7229642.cif.	7229642.cif
203880	2017-12-02	cif/ Adding structures of 7229642 via cif-deposit CGI script.	7229642.cif