Crystallography Open Database

Information card for entry 7710543

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Coordinates	7710543.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H27 Cl3 Ga O P
Calculated formula	C24 H27 Cl3 Ga O P
SMILES	[Ga](Cl)(Cl)(Cl)[O]=[PH2]c1c(c2c(cc(cc2C)C)C)cccc1c1c(cc(cc1C)C)C
Title of publication	Modulating the reactivity of phosphanylidenephosphoranes towards water with Lewis acids
Authors of publication	Dankert, Fabian; Fischer, Malte; Hering-Junghans, Christian
Journal of publication	Dalton Transactions
Year of publication	2022
a	19.5931 ± 0.001 Å
b	19.2681 ± 0.0009 Å
c	13.408 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	5061.8 ± 0.4 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	6
Space group number	41
Hermann-Mauguin space group symbol	A e a 2
Hall space group symbol	A 2 -2ab
Residual factor for all reflections	0.0293
Residual factor for significantly intense reflections	0.025
Weighted residual factors for significantly intense reflections	0.059
Weighted residual factors for all reflections included in the refinement	0.0597
Goodness-of-fit parameter for all reflections included in the refinement	0.997
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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