Crystallography Open Database

Information card for entry 2216949

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Structure parameters

Chemical name	Tetrakis(triphenylarsine)copper(I) hexafluoridophosphate
Formula	C72 H60 As4 Cu F6 P
Calculated formula	C72 H60 As4 Cu F6 P
SMILES	[P](F)(F)(F)(F)(F)[F-].c1(ccccc1)[As](c1ccccc1)(c1ccccc1)[Cu]([As](c1ccccc1)(c1ccccc1)c1ccccc1)([As](c1ccccc1)(c1ccccc1)c1ccccc1)[As](c1ccccc1)(c1ccccc1)c1ccccc1
Title of publication	Tetrakis(triphenylarsine)copper(I) hexafluoridophosphate
Authors of publication	Thomas Kern; Günther Knör; Manfred Zabel; Uwe Monkowius
Journal of publication	Acta Crystallographica Section E
Year of publication	2008
Journal volume	64
Journal issue	1
Pages of publication	m99 - m99
a	14.4025 ± 0.001 Å
b	14.4025 ± 0.001 Å
c	52.015 ± 0.004 Å
α	90°
β	90°
γ	120°
Cell volume	9344 ± 1.2 Å³
Cell temperature	296 K
Ambient diffraction temperature	296 ± 1 K
Number of distinct elements	6
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0514
Residual factor for significantly intense reflections	0.0371
Weighted residual factors for significantly intense reflections	0.0928
Weighted residual factors for all reflections included in the refinement	0.0965
Goodness-of-fit parameter for all reflections included in the refinement	1.044
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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