Crystallography Open Database

Information card for entry 7122466

Preview

Coordinates	7122466.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H16 Au2 N10
Calculated formula	C16 H16 Au2 N10
Title of publication	Correlating thermochromic and mechanochromic phosphorescence with polymorphs of a complex gold(i) double salt with infinite aurophilicity.
Authors of publication	Liu, Qi; Xie, Mo; Chang, Xiaoyong; Gao, Qin; Chen, Yong; Lu, Wei
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2018
Journal volume	54
Journal issue	91
Pages of publication	12844 - 12847
a	6.2753 ± 0.0007 Å
b	8.0957 ± 0.001 Å
c	18.757 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	952.91 ± 0.19 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	4
Space group number	31
Hermann-Mauguin space group symbol	P m n 21
Hall space group symbol	P 2ac -2
Residual factor for all reflections	0.0495
Residual factor for significantly intense reflections	0.0385
Weighted residual factors for significantly intense reflections	0.092
Weighted residual factors for all reflections included in the refinement	0.0984
Goodness-of-fit parameter for all reflections included in the refinement	1.12
Diffraction radiation probe	x-ray
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
228471 (current)	2019-11-17	cif/ Updating files of 7122465, 7122466, 7122467, 7122468, 7122469, 7122470, 7122471 Original log message: Adding full bibliography for 7122465--7122471.cif.	7122466.cif
211503	2018-10-18	cif/ Adding structures of 7122465, 7122466, 7122467, 7122468, 7122469, 7122470, 7122471 via cif-deposit CGI script.	7122466.cif