Crystallography Open Database

Information card for entry 4112826

Preview

Coordinates	4112826.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H44 Ag Au3 B2 F8 N3 O P3 S
Calculated formula	C51 H42 Ag Au3 B2 F8 N3 O2 P3 S
Title of publication	Intensely Luminescent Gold(I)-Silver(I) Cluster Complexes with Tunable Structural Features
Authors of publication	Quan-Ming Wang; Young-A. Lee; Olga Crespo; Joseph Deaton; Ching Tang; Henry J. Gysling; M. Concepción Gimeno; Carmen Larraz; M. Dolores Villacampa; Antonio Laguna; Richard Eisenberg
Journal of publication	Journal of the American Chemical Society
Year of publication	2004
Journal volume	126
Pages of publication	9488 - 9489
a	13.5222 ± 0.0006 Å
b	22.7307 ± 0.0011 Å
c	18.1594 ± 0.0009 Å
α	90°
β	105.379 ± 0.001°
γ	90°
Cell volume	5381.8 ± 0.4 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	10
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.0494
Residual factor for significantly intense reflections	0.0356
Weighted residual factors for significantly intense reflections	0.0897
Weighted residual factors for all reflections included in the refinement	0.0946
Goodness-of-fit parameter for all reflections included in the refinement	1.036
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
178899 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/28.	4112826.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4112826.cif
65243	2012-09-05	cif/ Adding structures of 4112826 via cif-deposit CGI script.	4112826.cif