Crystallography Open Database

Information card for entry 4085564

Preview

Coordinates	4085564.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H46 Cl6 P3 Pt Sb
Calculated formula	C56 H46 Cl6 P3 Pt Sb
SMILES	[Pt]123([Sb](Cl)(c4ccccc4[P]1(c1ccccc1)c1ccccc1)(c1ccccc1[P]2(c1ccccc1)c1ccccc1)c1ccccc1[P]3(c1ccccc1)c1ccccc1)Cl.ClCCl.ClCCl
Title of publication	Guilty on Two Counts: Stepwise Coordination of Two Fluoride Anions to the Antimony Atom of a Noninnocent Stibine Ligand
Authors of publication	Jones, James S.; Wade, Casey R.; Gabba\?ï, François P.
Journal of publication	Organometallics
Year of publication	2015
Journal volume	34
Journal issue	11
Pages of publication	2647
a	21.86 ± 0.004 Å
b	13.623 ± 0.002 Å
c	17.265 ± 0.003 Å
α	90°
β	90.061 ± 0.002°
γ	90°
Cell volume	5141.5 ± 1.5 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0522
Residual factor for significantly intense reflections	0.0369
Weighted residual factors for significantly intense reflections	0.088
Weighted residual factors for all reflections included in the refinement	0.0975
Goodness-of-fit parameter for all reflections included in the refinement	1.045
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
178744 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/55.	4085564.cif
140245	2015-07-05	cif/ Updating files of 4085560, 4085561, 4085562, 4085563, 4085564 Original log message: Adding full bibliography for 4085560--4085564.cif.	4085564.cif
132447	2015-02-26	cif/ Adding structures of 4085564 via cif-deposit CGI script.	4085564.cif