Crystallography Open Database

Information card for entry 1512460

Preview

Coordinates	1512460.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H12 Au2 F10 N2
Calculated formula	C30 H12 Au2 F10 N2
SMILES	[Au]([n]1c(c2ccccc2cc1)c1[n]([Au]c2c(F)c(F)c(F)c(F)c2F)ccc2ccccc12)c1c(F)c(F)c(F)c(F)c1F
Title of publication	Mono- and dinuclear luminescent 1,1'-biisoquinoline gold(I) complexes
Authors of publication	Manuel Bardaji; Ana B. Miguel-Coello; Pablo Espinet
Journal of publication	Inorganica Chimica Acta
Year of publication	2012
Journal volume	392
Pages of publication	91 - 98
a	16.478 ± 0.005 Å
b	16.319 ± 0.005 Å
c	12.87 ± 0.004 Å
α	90°
β	115.459 ± 0.005°
γ	90°
Cell volume	3124.7 ± 1.7 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
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	0.0747
Residual factor for significantly intense reflections	0.0408
Weighted residual factors for significantly intense reflections	0.1035
Weighted residual factors for all reflections included in the refinement	0.1164
Goodness-of-fit parameter for all reflections included in the refinement	1.093
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
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1512460.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1512460.cif
89389	2013-10-24	cif/ Adding structures of 1512460 via cif-deposit CGI script.	1512460.cif