Crystallography Open Database

Information card for entry 4335615

Preview

Coordinates	4335615.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	magnesium octastrontium octadeca-borate
Formula	B18 Mg O36 Sr8
Calculated formula	B18 Mg O36 Sr8
Title of publication	Sr8MgB18O36: a New Alkaline-Earth Borate with a Novel Zero-Dimensional (B18O36)18- Anion Ring
Authors of publication	Wenjiao Yao; Xingxing Jiang; Hongwei Huang; Tao Xu; Xiaoshan Wang; Zheshuai Lin; Chuangtian Chen
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	8291 - 8293
a	11.4271 ± 0.0016 Å
b	11.4271 ± 0.0016 Å
c	36.913 ± 0.007 Å
α	90°
β	90°
γ	120°
Cell volume	4174.3 ± 1.1 Å³
Cell temperature	143.15 K
Ambient diffraction temperature	143.15 K
Number of distinct elements	4
Space group number	167
Hermann-Mauguin space group symbol	R -3 c :H
Hall space group symbol	-R 3 2"c
Residual factor for all reflections	0.0363
Residual factor for significantly intense reflections	0.0331
Weighted residual factors for significantly intense reflections	0.0618
Weighted residual factors for all reflections included in the refinement	0.0627
Goodness-of-fit parameter for all reflections included in the refinement	1.293
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4335615.cif
101550	2014-02-14	cif/ Adding structures of 4335615 via cif-deposit CGI script.	4335615.cif