Crystallography Open Database

Information card for entry 1519065

1519064 << 1519065 >> 1519066

Preview

Coordinates	1519065.cif

Structure parameters

Formula	Br2 F12 Pb7
Calculated formula	Br2 F12 Pb7
SMILES	[Pb+2].[Pb+2].[Pb+2].[Pb+2].[Pb+2].[Pb+2].[Pb+2].[Br-].[Br-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-]
Title of publication	Hydrothermal synthesis and structure of the ordered modification of Pb7F12Br2
Authors of publication	F. Kubel; H. Vollenkle
Journal of publication	Solid State Sciences
Year of publication	2000
Journal volume	2
Pages of publication	193 - 196
a	10.356 ± 0.002 Å
b	10.356 ± 0.002 Å
c	4.0224 ± 0.0008 Å
α	90°
β	90°
γ	120°
Cell volume	373.59 ± 0.13 Å³
Ambient diffraction temperature	293 K
Number of distinct elements	3
Space group number	174
Hermann-Mauguin space group symbol	P -6
Hall space group symbol	P -6
Residual factor for significantly intense reflections	0.028
Weighted residual factors for significantly intense reflections	0.059
Goodness-of-fit parameter for all reflections included in the refinement	1.027
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
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1519065.cif
135323	2015-04-17	cif/ Adding structures of 1519065 via cif-deposit CGI script.	1519065.cif