Crystallography Open Database

Information card for entry 4131886

Preview

Coordinates	4131886.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H23 Au F3 N O2
Calculated formula	C26 H23 Au F3 N O2
Title of publication	Mechanical-Stimulation-Triggered and Solvent-Vapor-Induced Reverse Single-Crystal-to-Single-Crystal Phase Transitions with Alterations of the Luminescence Color.
Authors of publication	Jin, Mingoo; Sumitani, Toshiki; Sato, Hiroyasu; Seki, Tomohiro; Ito, Hajime
Journal of publication	Journal of the American Chemical Society
Year of publication	2018
Journal volume	140
Journal issue	8
Pages of publication	2875 - 2879
a	6.4976 ± 0.0003 Å
b	14.353 ± 0.0007 Å
c	24.8911 ± 0.0012 Å
α	90°
β	90°
γ	90°
Cell volume	2321.35 ± 0.19 Å³
Cell temperature	93 K
Ambient diffraction temperature	93 K
Number of distinct elements	6
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0533
Residual factor for significantly intense reflections	0.0369
Weighted residual factors for significantly intense reflections	0.0767
Weighted residual factors for all reflections included in the refinement	0.0812
Goodness-of-fit parameter for all reflections included in the refinement	1.022
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
241980 (current)	2019-11-25	cif/ Adding structures of 4131886, 4131887, 4131888, 4131889 via cif-deposit CGI script.	4131886.cif