Crystallography Open Database

Information card for entry 4343619

Preview

Coordinates	4343619.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	6
Formula	C46 H48 Au Cu2 F18 N12 O4 P3
Calculated formula	C46 H48 Au Cu2 F18 N12 O4 P3
Title of publication	Luminescent Mechanochromism in a Gold(I)-Copper(I) N-Heterocyclic Carbene Complex.
Authors of publication	Chen, Kelly; Nenzel, Michelle M.; Brown, Thomas M.; Catalano, Vincent J.
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	14
Pages of publication	6900 - 6909
a	8.1559 ± 0.0006 Å
b	12.6903 ± 0.0009 Å
c	13.6732 ± 0.0009 Å
α	81.8321 ± 0.0014°
β	84.8442 ± 0.0013°
γ	76.6665 ± 0.0013°
Cell volume	1360.67 ± 0.17 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0707
Residual factor for significantly intense reflections	0.046
Weighted residual factors for significantly intense reflections	0.08
Weighted residual factors for all reflections included in the refinement	0.0872
Goodness-of-fit parameter for all reflections included in the refinement	1.01
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
152816 (current)	2015-08-05	cif/ Updating files of 4343616, 4343617, 4343618, 4343619 Original log message: Adding full bibliography for 4343616--4343619.cif.	4343619.cif
141499	2015-07-10	cif/ Adding structures of 4343616, 4343617, 4343618, 4343619 via cif-deposit CGI script.	4343619.cif