Crystallography Open Database

Information card for entry 4308160

Preview

Coordinates	4308160.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H34 Au N2 P
Calculated formula	C31 H34 Au N2 P
SMILES	C12C(C=CC=CC=1)=[N]([Au](N2C(C)C)[P](c1ccccc1)(c1ccccc1)c1ccccc1)C(C)C
Title of publication	Three-Coordinated Aminotroponiminate and Aminotroponate Complexes of Gold(I)
Authors of publication	Jenni Meiners; Jost-Steffen Herrmann; Peter W. Roesky
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	4599 - 4604
a	14.3624 ± 0.0007 Å
b	10.3495 ± 0.0004 Å
c	19.4897 ± 0.0009 Å
α	90°
β	106.771 ± 0.004°
γ	90°
Cell volume	2773.8 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
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	0.0491
Residual factor for significantly intense reflections	0.0329
Weighted residual factors for significantly intense reflections	0.0733
Weighted residual factors for all reflections included in the refinement	0.078
Goodness-of-fit parameter for all reflections included in the refinement	1.023
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
179119 (current)	2016-03-22	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/81.	4308160.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4308160.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4308160.cif
1194	2010-06-06	cif/4/ Adding data from Inorg-Chem-2007_01-13/ processing directory.	4308160.cif