Crystallography Open Database

Information card for entry 7225019

Preview

Coordinates	7225019.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H8 Mg N2 O6
Calculated formula	C6 H8 Mg N2 O6
Title of publication	Structural, thermal, dielectric and phonon properties of perovskite-like imidazolium magnesium formate.
Authors of publication	Mączka, Mirosław; Marinho Costa, Nathalia Leal; Gągor, Anna; Paraguassu, Waldeci; Sieradzki, Adam; Hanuza, Jerzy
Journal of publication	Physical chemistry chemical physics : PCCP
Year of publication	2016
Journal volume	18
Journal issue	20
Pages of publication	13993 - 14000
a	12.1246 ± 0.0004 Å
b	12.2087 ± 0.0005 Å
c	12.4991 ± 0.0004 Å
α	90°
β	91.394 ± 0.003°
γ	90°
Cell volume	1849.64 ± 0.11 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0865
Residual factor for significantly intense reflections	0.0458
Weighted residual factors for significantly intense reflections	0.0966
Weighted residual factors for all reflections included in the refinement	0.1142
Goodness-of-fit parameter for all reflections included in the refinement	1.025
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
183792 (current)	2016-06-18	cif/ Updating files of 7225019 Original log message: Adding full bibliography for 7225019.cif.	7225019.cif
182375	2016-04-28	cif/ Adding structures of 7225019 via cif-deposit CGI script.	7225019.cif