Crystallography Open Database

Information card for entry 4329207

Preview

Coordinates	4329207.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C7 H6 Au Cl3 N2
Calculated formula	C7 H6 Au Cl3 N2
SMILES	[Au](Cl)(Cl)([NH2]c1ccc(cc1)C#N)Cl
Title of publication	Gold(III) Diazonium Complexes for Electrochemical Reductive Grafting
Authors of publication	Atiya T. Overton; Ahmed A. Mohamed
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	5500 - 5502
a	8.379 ± 0.005 Å
b	20.82 ± 0.013 Å
c	6.436 ± 0.004 Å
α	90°
β	114.962 ± 0.006°
γ	90°
Cell volume	1017.9 ± 1.1 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	5
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0242
Residual factor for significantly intense reflections	0.0213
Weighted residual factors for significantly intense reflections	0.0489
Weighted residual factors for all reflections included in the refinement	0.081
Goodness-of-fit parameter for all reflections included in the refinement	1.091
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
179395 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/92.	4329207.cif
78247	2013-04-01	cif/ Adding structures of 4329207 via cif-deposit CGI script.	4329207.cif