Crystallography Open Database

Information card for entry 4304495

Preview

Coordinates	4304495.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ag23 Br Te12
Calculated formula	Ag22.974 Br Te12
Title of publication	Crystal Structures and Thermal and Electrical Properties of the New Silver (poly)Chalcogenide Halides Ag23Te12Cl and Ag23Te12Br
Authors of publication	Stefan Lange; Melanie Bawohl; Tom Nilges
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	2625 - 2633
a	21.1517 ± 0.0015 Å
b	21.1517 ± 0.0015 Å
c	7.7591 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	3471.4 ± 0.4 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	3
Space group number	58
Hermann-Mauguin space group symbol	P n n m
Hall space group symbol	-P 2 2n
Residual factor for all reflections	0.1167
Residual factor for significantly intense reflections	0.0404
Weighted residual factors for significantly intense reflections	0.0461
Weighted residual factors for all reflections included in the refinement	0.0565
Goodness-of-fit parameter for significantly intense reflections	1.6
Goodness-of-fit parameter for all reflections included in the refinement	1.08
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4304495.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4304495.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4304495.cif
1163	2010-05-11	cif/4/: committing data from the Inorg-Chem-2008_01-12/ deposition.	4304495.cif