Crystallography Open Database

Information card for entry 4330680

Preview

Coordinates	4330680.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H8 As F28 I O2
Calculated formula	C26 H8 As F28 I O2
SMILES	c12ccccc1C(C(C(F)(F)C(F)(F)F)(F)F)(O[As]12(c2ccccc2C(C(C(F)(F)C(F)(F)F)(F)F)(O1)C(F)(F)C(C(F)(F)F)(F)F)I)C(F)(F)C(C(F)(F)F)(F)F
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	22.931 ± 0.0004 Å
b	15.03 ± 0.0003 Å
c	9.661 ± 0.0003 Å
α	90°
β	100.717 ± 0.001°
γ	90°
Cell volume	3271.61 ± 0.13 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	6
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	0.0469
Residual factor for significantly intense reflections	0.0413
Weighted residual factors for significantly intense reflections	0.114
Weighted residual factors for all reflections included in the refinement	0.1326
Goodness-of-fit parameter for all reflections included in the refinement	1.257
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.	4330680.cif
80135	2013-04-06	cif/ Adding structures of 4330680 via cif-deposit CGI script.	4330680.cif