Crystallography Open Database

Information card for entry 7703422

Preview

Coordinates	7703422.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Co15 F2 O42 Te14
Calculated formula	Co15 F2 O42 Te14
Title of publication	Lone-pair self-containment in pyritohedron-shaped closed cavities: optimized hydrothermal synthesis, structure, magnetism and lattice thermal conductivity of Co<sub>15</sub>F<sub>2</sub>(TeO<sub>3</sub>)<sub>14</sub>.
Authors of publication	Lü, Minfeng; Jiang, Jianhua; Zhu, Bei; Zhao, Yuwei; Zhu, Tianyu; Yang, Haoming; Jin, Yong; Kabbour, Houria; Choi, Kwang-Yong; Harrison, William T. A.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	7
Pages of publication	2234 - 2243
a	11.6649 ± 0.0004 Å
b	11.6649 ± 0.0004 Å
c	27.3173 ± 0.001 Å
α	90°
β	90°
γ	120°
Cell volume	3219.1 ± 0.2 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	4
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0252
Residual factor for significantly intense reflections	0.0223
Weighted residual factors for significantly intense reflections	0.0445
Weighted residual factors for all reflections included in the refinement	0.0453
Goodness-of-fit parameter for all reflections included in the refinement	1.179
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
248966 (current)	2020-03-05	cif/ Updating files of 7703422 Original log message: Adding full bibliography for 7703422.cif.	7703422.cif
247429	2020-02-01	cif/ Adding structures of 7703422 via cif-deposit CGI script.	7703422.cif