Crystallography Open Database

Information card for entry 7027536

Preview

Coordinates	7027536.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H46 Ag Au2 Cl N2 O4 P2
Calculated formula	C50 H46 Ag Au2 Cl N2 O4 P2
Title of publication	Synthesis and reactivity of [Au(2-CH2-6-RC5H3N)(PPh3)] (R = H, Me). X-Ray structure of [Ag{Au(2-CH2-6-MeC5H3N)(PPh3)}2][ClO4]
Authors of publication	Casas, J. Enrique; Gimeno, M. Concepción; Jones, Peter G.; Laguna, Antonio; Laguna, Mariano
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	1999
Journal issue	16
Pages of publication	2819
a	14.593 ± 0.005 Å
b	17.237 ± 0.006 Å
c	19.33 ± 0.007 Å
α	90°
β	108.11 ± 0.03°
γ	90°
Cell volume	4621 ± 3 Å³
Cell temperature	178 ± 2 K
Ambient diffraction temperature	178 ± 2 K
Number of distinct elements	8
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0469
Residual factor for significantly intense reflections	0.0306
Weighted residual factors for significantly intense reflections	0.0711
Weighted residual factors for all reflections included in the refinement	0.0812
Goodness-of-fit parameter for all reflections included in the refinement	1.075
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179981 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/75.	7027536.cif
95450	2014-01-28	cif/ Adding structures of 7027536 via cif-deposit CGI script.	7027536.cif