Crystallography Open Database

Information card for entry 4335257

Preview

Coordinates	4335257.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H19 Bi Cl F6 N O6 P2 S2
Calculated formula	C10 H19 Bi Cl F6 N O6 P2 S2
Title of publication	Coordination Complexes of Bismuth Triflates with Tetrahydrofuran and Diphosphine Ligands
Authors of publication	Chitnis, Saurabh S.; Burford, Neil; Decken, Andreas; Ferguson, Michael J.
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Journal issue	12
Pages of publication	7242 - 7248
a	12.602 ± 0.0015 Å
b	16.2877 ± 0.0019 Å
c	12.8527 ± 0.0015 Å
α	90°
β	118.648 ± 0.001°
γ	90°
Cell volume	2315.2 ± 0.5 Å³
Cell temperature	173 ± 1 K
Ambient diffraction temperature	173 ± 1 K
Number of distinct elements	9
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.032
Residual factor for significantly intense reflections	0.0272
Weighted residual factors for significantly intense reflections	0.0638
Weighted residual factors for all reflections included in the refinement	0.0663
Goodness-of-fit parameter for all reflections included in the refinement	1.058
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
209508 (current)	2018-08-09	cif/4/33/52/ Updating bibliography in entries 4335255, 4335256, 4335257, 4335258, 4335259.	4335257.cif
179455	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 4/33/52.	4335257.cif
101166	2014-02-10	cif/ Adding structures of 4335257 via cif-deposit CGI script.	4335257.cif