Crystallography Open Database

Information card for entry 7718258

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Coordinates	7718258.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C47 H29 Au N O P
Calculated formula	C47 H29 Au N O P
Title of publication	Cyclometalated Au(III) complexes with alkynylphosphine oxide ligands: synthesis and photophysical properties.
Authors of publication	Luginin, Maksim; Snetkov, Dmitry; Sizova, Anastasia; Paderina, Aleksandra; Sizov, Vladimir; Grachova, Elena
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
Journal volume	54
Journal issue	7
Pages of publication	2950 - 2963
a	14.0966 ± 0.0001 Å
b	20.6876 ± 0.0002 Å
c	11.9457 ± 0.0001 Å
α	90°
β	96.358 ± 0.001°
γ	90°
Cell volume	3462.24 ± 0.05 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0327
Residual factor for significantly intense reflections	0.0298
Weighted residual factors for significantly intense reflections	0.0704
Weighted residual factors for all reflections included in the refinement	0.0721
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
297969 (current)	2025-03-04	cif/ Adding structures of 7718253, 7718254, 7718255, 7718256, 7718257, 7718258, 7718259 via cif-deposit CGI script.	7718258.cif