Crystallography Open Database

Information card for entry 7113400

Preview

Coordinates	7113400.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H23.5 Au F6 N2.5 P
Calculated formula	C22 H15 Au F6 N2.5 P
Title of publication	Reaction of gold(III) oxo complexes with alkenes. Synthesis of unprecedented gold alkene complexes, [Au(N,N)(alkene)][PF6]. Crystal structure of [Au(bipy(ip))(eta2-CH2=CHPh)][PF6] (bipy(ip) = 6-isopropyl-2,2'-bipyridine).
Authors of publication	Cinellu, Maria A.; Minghetti, Giovanni; Stoccoro, Sergio; Zucca, Antonio; Manassero, Mario
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2004
Journal issue	14
Pages of publication	1618 - 1619
a	13.717 ± 0.001 Å
b	12.833 ± 0.001 Å
c	15.272 ± 0.002 Å
α	90°
β	114.15 ± 0.01°
γ	90°
Cell volume	2453 ± 0.5 Å³
Cell temperature	223 K
Ambient diffraction temperature	223 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	0.054
Residual factor for significantly intense reflections	0.054
Weighted residual factors for significantly intense reflections	0.09
Goodness-of-fit parameter for all reflections	1.391
Goodness-of-fit parameter for significantly intense reflections	1.391
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	Mo-Kα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7113400.cif
114627	2014-05-28	cif/ Adding structures of 7113400 via cif-deposit CGI script.	7113400.cif