Crystallography Open Database

Information card for entry 4029689

Preview

Coordinates	4029689.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H23 Au Cl O P
Calculated formula	C32 H23 Au Cl O P
SMILES	[Au](Cl)[P](c1ccc2ccccc2c1c1c2ccccc2ccc1O)(c1ccccc1)c1ccccc1
Title of publication	Synthesis of axially chiral gold complexes and their applications in asymmetric catalyses.
Authors of publication	Sun, Yin-Wei; Xu, Qin; Shi, Min
Journal of publication	Beilstein journal of organic chemistry
Year of publication	2013
Journal volume	9
Pages of publication	2224 - 2232
a	9.0411 ± 0.0007 Å
b	13.4833 ± 0.001 Å
c	21.9878 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	2680.4 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0468
Residual factor for significantly intense reflections	0.0378
Weighted residual factors for significantly intense reflections	0.068
Weighted residual factors for all reflections included in the refinement	0.0707
Goodness-of-fit parameter for all reflections included in the refinement	0.982
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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