Crystallography Open Database

Information card for entry 7019466

7019465 << 7019466 >> 7019467

Preview

Coordinates	7019466.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H42 Au Cl13 N3 O6 P
Calculated formula	C46.01 H41.03 Au Cl13 N3 O6 P
Title of publication	Phosphate binding to the [Au(IPr)] moiety: inner vs. outer sphere coordination behaviour.
Authors of publication	Gaillard, Sylvain; Rix, Diane; Slawin, Alexandra M. Z.; Lacour, Jérôme; Nolan, Steven P.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	27
Pages of publication	8235 - 8237
a	13.28 ± 0.005 Å
b	13.599 ± 0.005 Å
c	16.803 ± 0.005 Å
α	79.1 ± 0.03°
β	68.36 ± 0.02°
γ	81.5 ± 0.03°
Cell volume	2759.6 ± 1.7 Å³
Cell temperature	93 ± 2 K
Ambient diffraction temperature	93 ± 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	0.2107
Residual factor for significantly intense reflections	0.1743
Weighted residual factors for significantly intense reflections	0.4154
Weighted residual factors for all reflections included in the refinement	0.4632
Goodness-of-fit parameter for all reflections included in the refinement	1.442
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
179898 (current)	2016-03-25	cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/94.	7019466.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7019466.cif
62876	2012-07-09	cif/ Adding structures of 7019465, 7019466 via cif-deposit CGI script.	7019466.cif