Crystallography Open Database

Information card for entry 4348891

Preview

Coordinates	4348891.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H36 Au2 N O3 P
Calculated formula	C48 H36 Au2 N O3 P
SMILES	[Au]12(c3ccccc3c3[n]1c(ccc3)c1ccccc21)C#Cc1ccc(cc1)C#C[Au][P](c1ccc(OC)cc1)(c1ccc(OC)cc1)c1ccc(OC)cc1
Title of publication	Synthesis, luminescence and electrochemical properties of luminescent dinuclear mixed-valence gold complexes with alkynyl bridges
Authors of publication	Hung, Ling-Ling; Lam, Wai Han; Wong, Keith Man-Chung; Cheng, Eddie Chung-Chin; Zhu, Nianyong; Yam, Vivian Wing-Wah
Journal of publication	Inorganic Chemistry Frontiers
Year of publication	2015
Journal volume	2
Journal issue	5
Pages of publication	453
a	14.402 ± 0.003 Å
b	14.505 ± 0.003 Å
c	39.229 ± 0.009 Å
α	90°
β	100.194 ± 0.004°
γ	90°
Cell volume	8066 ± 3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
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	0.0768
Residual factor for significantly intense reflections	0.0564
Weighted residual factors for significantly intense reflections	0.1204
Weighted residual factors for all reflections included in the refinement	0.128
Goodness-of-fit parameter for all reflections included in the refinement	1.148
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
233471 (current)	2019-11-23	cif/ Adding structures of 4348889, 4348890, 4348891 via cif-deposit CGI script.	4348891.cif