Crystallography Open Database

Information card for entry 4330676

Preview

Coordinates	4330676.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H9 As F28 O3
Calculated formula	C26 H9 As F28 O3
SMILES	c12ccccc1C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)O[As]12(c2ccccc2C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)O1)O
Title of publication	Synthesis and Characterization of Antiapicophilic Arsoranes and Related Compounds
Authors of publication	Xin-Dong Jiang; Shiro Matsukawa; Satoshi Kojima; Yohsuke Yamamoto
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	10996 - 11006
a	9.834 ± 0.0002 Å
b	12.664 ± 0.0003 Å
c	13.986 ± 0.0002 Å
α	75.133 ± 0.002°
β	69.443 ± 0.001°
γ	77.572 ± 0.001°
Cell volume	1561.14 ± 0.06 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.056
Residual factor for significantly intense reflections	0.0521
Weighted residual factors for significantly intense reflections	0.1414
Weighted residual factors for all reflections included in the refinement	0.1519
Goodness-of-fit parameter for all reflections included in the refinement	1.069
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179409 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/06.	4330676.cif
80131	2013-04-06	cif/ Adding structures of 4330676 via cif-deposit CGI script.	4330676.cif