Crystallography Open Database

Information card for entry 4119537

4119536 << 4119537 >> 4119538

Preview

Coordinates	4119537.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	F15 H Sb2 Xe
Calculated formula	F15 Sb2 Xe
SMILES	F[Sb](F)(F)([F][Sb](F)(F)(F)(F)F)(F)F.[Xe](F)(F)(F)F
Title of publication	[H(OXeF2)n][AsF6] and [FXeII(OXeIVF2)n][AsF6] (n= 1, 2): Examples of Xenon(IV) Hydroxide Fluoride and Oxide Fluoride Cations and the Crystal Structures of [F3Xe—FH][Sb2F11] and [H5F4][SbF6].2[F3Xe—FH][Sb2F11]
Authors of publication	David S. Brock; Hélène P. A. Mercier; Gary J. Schrobilgen
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	5089 - 5104
a	13.412 ± 0.0004 Å
b	8.4709 ± 0.0004 Å
c	10.4543 ± 0.0004 Å
α	90°
β	110.493 ± 0.002°
γ	90°
Cell volume	1112.57 ± 0.08 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0321
Residual factor for significantly intense reflections	0.025
Weighted residual factors for significantly intense reflections	0.0562
Weighted residual factors for all reflections included in the refinement	0.0582
Goodness-of-fit parameter for all reflections included in the refinement	1.15
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
178966 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/95.	4119537.cif
103695	2014-03-06	cif/ Adding structures of 4119537 via cif-deposit CGI script.	4119537.cif