Crystallography Open Database

Information card for entry 4085669

Preview

Coordinates	4085669.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C69 H57 Au Cl F P3 Si
Calculated formula	C69 H57 Au Cl F P3 Si
Title of publication	Evaluation of the σ-Donation from Group 11 Metals (Cu, Ag, Au) to Silane, Germane, and Stannane Based on the Experimental/Theoretical Systematic Approach
Authors of publication	Kameo, Hajime; Kawamoto, Tatsuya; Bourissou, Didier; Sakaki, Shigeyoshi; Nakazawa, Hiroshi
Journal of publication	Organometallics
Year of publication	2015
Journal volume	34
Journal issue	8
Pages of publication	1440
a	12.696 ± 0.003 Å
b	16.721 ± 0.004 Å
c	16.95 ± 0.004 Å
α	65.119 ± 0.01°
β	64.757 ± 0.011°
γ	76.911 ± 0.013°
Cell volume	2947.8 ± 1.3 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0874
Residual factor for significantly intense reflections	0.075
Weighted residual factors for significantly intense reflections	0.1402
Weighted residual factors for all reflections included in the refinement	0.1457
Goodness-of-fit parameter for all reflections included in the refinement	1.184
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178745 (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 4/08/56.	4085669.cif
138305	2015-06-05	cif/ Updating files of 4085667, 4085668, 4085669, 4085670, 4085671, 4085672, 4085673, 4085674, 4085675 Original log message: Adding full bibliography for 4085667--4085675.cif.	4085669.cif
135157	2015-04-09	cif/ Adding structures of 4085667, 4085668, 4085669, 4085670, 4085671, 4085672, 4085673, 4085674, 4085675 via cif-deposit CGI script.	4085669.cif