Crystallography Open Database

Information card for entry 4517585

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Coordinates	4517585.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H78 Au B F4 N2
Calculated formula	C56 H78 Au B F4 N2
Title of publication	Influence of Carbene and Phosphine Ligands on the Catalytic Activity of Gold Complexes in the Hydroamination and Hydrohydrazination of Alkynes
Authors of publication	Yazdani, Sima; Junor, Glen P.; Peltier, Jesse L.; Gembicky, Milan; Jazzar, Rodolphe; Grotjahn, Douglas B.; Bertrand, Guy
Journal of publication	ACS Catalysis
Year of publication	2020
Pages of publication	5190
a	17.9392 ± 0.0011 Å
b	18.2892 ± 0.001 Å
c	17.3878 ± 0.001 Å
α	90°
β	118.402 ± 0.002°
γ	90°
Cell volume	5018.1 ± 0.5 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	6
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.031
Residual factor for significantly intense reflections	0.0188
Weighted residual factors for significantly intense reflections	0.0427
Weighted residual factors for all reflections included in the refinement	0.0476
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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