Crystallography Open Database

Information card for entry 4130882

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Coordinates	4130882.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C47 H58 Au N
Calculated formula	C47 H58 Au N
Title of publication	Evidence for Direct Transmetalation of Au<sup>III</sup>-F with Boronic Acids.
Authors of publication	Kumar, Roopender; Linden, Anthony; Nevado, Cristina
Journal of publication	Journal of the American Chemical Society
Year of publication	2016
Journal volume	138
Journal issue	42
Pages of publication	13790 - 13793
a	18.8532 ± 0.001 Å
b	10.5063 ± 0.0006 Å
c	19.8505 ± 0.0014 Å
α	90°
β	93.844 ± 0.005°
γ	90°
Cell volume	3923.1 ± 0.4 Å³
Cell temperature	160 ± 1 K
Ambient diffraction temperature	160 ± 1 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/a 1
Hall space group symbol	-P 2yab
Residual factor for all reflections	0.0996
Residual factor for significantly intense reflections	0.0608
Weighted residual factors for significantly intense reflections	0.1307
Weighted residual factors for all reflections included in the refinement	0.1529
Goodness-of-fit parameter for all reflections included in the refinement	1.025
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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