Crystallography Open Database

Information card for entry 4085912

Preview

Coordinates	4085912.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45 H51 F6 P3 Pt3 Si3
Calculated formula	C45 H51 F6 P3 Pt3 Si3
SMILES	[Pt]123([Pt]4([Pt]1([P](C)(C)C)([Si]4(c1ccc(F)cc1)c1ccc(F)cc1)[Si]2(c1ccc(F)cc1)c1ccc(F)cc1)([P](C)(C)C)[Si]3(c1ccc(F)cc1)c1ccc(F)cc1)[P](C)(C)C
Title of publication	Ring Expansion of Cyclic Triplatinum(0) Silylene Complexes Induced by Insertion of Alkyne into a Si‒Pt Bond
Authors of publication	Tanaka, Kimiya; Kamono, Megumi; Tanabe, Makoto; Osakada, Kohtaro
Journal of publication	Organometallics
Year of publication	2015
Journal volume	34
Journal issue	12
Pages of publication	2985
a	14.329 ± 0.002 Å
b	27.885 ± 0.003 Å
c	12.582 ± 0.002 Å
α	90°
β	101.772 ± 0.007°
γ	90°
Cell volume	4921.6 ± 1.2 Å³
Cell temperature	153 K
Ambient diffraction temperature	153 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	0.068
Residual factor for significantly intense reflections	0.0509
Weighted residual factors for significantly intense reflections	0.122
Weighted residual factors for all reflections included in the refinement	0.1336
Goodness-of-fit parameter for all reflections included in the refinement	1.112
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
140193 (current)	2015-07-05	cif/ Updating files of 4085912, 4085913, 4085914 Original log message: Adding full bibliography for 4085912--4085914.cif.	4085912.cif
137544	2015-05-30	cif/ Adding structures of 4085912, 4085913, 4085914 via cif-deposit CGI script.	4085912.cif