Crystallography Open Database

Information card for entry 7037405

Preview

Coordinates	7037405.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C H6 Cl Er3 O9
Calculated formula	C H6 Cl1.005 Er3 O9
Title of publication	Sodalite-like rare-earth carbonates: a study of structural transformation and diluted magnetism.
Authors of publication	Wang, Yanyan; Han, Tian; Ding, You-Song; Zheng, Zhiping; Zheng, Yan-Zhen
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	3
Pages of publication	1103 - 1110
a	12.4127 ± 0.0004 Å
b	12.4127 ± 0.0004 Å
c	12.4127 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	1912.49 ± 0.11 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	229
Hermann-Mauguin space group symbol	I m -3 m
Hall space group symbol	-I 4 2 3
Residual factor for all reflections	0.0553
Residual factor for significantly intense reflections	0.049
Weighted residual factors for significantly intense reflections	0.1261
Weighted residual factors for all reflections included in the refinement	0.1313
Goodness-of-fit parameter for all reflections included in the refinement	1.115
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
176048 (current)	2016-02-05	cif/ Updating files of 7037404, 7037405, 7037406, 7037407 Original log message: Adding full bibliography for 7037404--7037407.cif.	7037405.cif
170500	2015-11-24	cif/ Adding structures of 7037404, 7037405, 7037406, 7037407 via cif-deposit CGI script.	7037405.cif