Crystallography Open Database

Information card for entry 7057004

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Coordinates	7057004.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H12 Au Cl0 F5 P S
Calculated formula	C19 H12 Au F5 P S
Title of publication	Aurophilicity vs. thiophilicity: directing the crystalline supramolecular arrangement in luminescent gold compounds
Authors of publication	Moreno-Alcántar, Guillermo; Romo-Islas, Guillermo; Flores-Álamo, Marcos; Torrens, Hugo
Journal of publication	New Journal of Chemistry
Year of publication	2018
Journal volume	42
Journal issue	10
Pages of publication	7845
a	8.9864 ± 0.0005 Å
b	11.0902 ± 0.0004 Å
c	11.4091 ± 0.0006 Å
α	91.56 ± 0.004°
β	113.048 ± 0.005°
γ	105.14 ± 0.004°
Cell volume	999.18 ± 0.1 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0354
Residual factor for significantly intense reflections	0.029
Weighted residual factors for significantly intense reflections	0.0569
Weighted residual factors for all reflections included in the refinement	0.0605
Goodness-of-fit parameter for all reflections included in the refinement	1.018
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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