Crystallography Open Database

Information card for entry 1550504

Preview

Coordinates	1550504.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H27 Au O P2
Calculated formula	C35 H27 Au O P2
SMILES	[Au]([P](c1ccccc1)(c1ccccc1)c1ccccc1)p1c(cc(cc1=O)c1ccccc1)c1ccccc1
Title of publication	Making the Unconventional μ2-P Bridging Binding Mode More Conventional in Phosphinine Complexes
Authors of publication	Gruetzmacher, Hansjoerg; Hou, Yuanfeng; Li, Zhongshu; Li, Yaqi; Su, Cheng-Yong; Puschmann, Florian; Liu, Peng
Journal of publication	Chemical Science
Year of publication	2019
a	10.7949 ± 0.0004 Å
b	11.5285 ± 0.0006 Å
c	11.9802 ± 0.0005 Å
α	87.576 ± 0.004°
β	84.28 ± 0.004°
γ	71.512 ± 0.004°
Cell volume	1406.85 ± 0.11 Å³
Cell temperature	149.98 ± 0.1 K
Ambient diffraction temperature	149.98 ± 0.1 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.055
Residual factor for significantly intense reflections	0.049
Weighted residual factors for significantly intense reflections	0.1211
Weighted residual factors for all reflections included in the refinement	0.1281
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
213240 (current)	2019-01-22	cif/ Adding structures of 1550495, 1550496, 1550497, 1550498, 1550499, 1550500, 1550501, 1550502, 1550503, 1550504 via cif-deposit CGI script.	1550504.cif