Crystallography Open Database

Information card for entry 1568010

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Coordinates	1568010.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H26 Au B Cl O P
Calculated formula	C36 H26 Au B Cl O P
Title of publication	Placing gold on a π±surface: ligand design and impact on reactivity
Authors of publication	Liu, Wei-Chun; Gabbaï, François P.
Journal of publication	Chemical Science
Year of publication	2023
Journal volume	14
Journal issue	2
Pages of publication	277 - 283
a	10.4379 ± 0.0003 Å
b	12.0326 ± 0.0004 Å
c	12.5622 ± 0.0004 Å
α	79.075 ± 0.001°
β	70.549 ± 0.001°
γ	74.216 ± 0.001°
Cell volume	1423.07 ± 0.08 Å³
Cell temperature	110 K
Ambient diffraction temperature	110 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	0.0153
Residual factor for significantly intense reflections	0.014
Weighted residual factors for significantly intense reflections	0.0326
Weighted residual factors for all reflections included in the refinement	0.033
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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