Crystallography Open Database

Information card for entry 7708480

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Coordinates	7708480.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H80 P4
Calculated formula	C60 H80 P4
Title of publication	Phosphine-catalysed reductive coupling of Dihalophosphanes
Authors of publication	Siewert, Jan-Erik; Schumann, André; Hering-Junghans, Christian
Journal of publication	Dalton Transactions
Year of publication	2021
a	11.9767 ± 0.0002 Å
b	11.9767 ± 0.0002 Å
c	19.3408 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	2774.27 ± 0.09 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	3
Space group number	118
Hermann-Mauguin space group symbol	P -4 n 2
Hall space group symbol	P -4 -2n
Residual factor for all reflections	0.0418
Residual factor for significantly intense reflections	0.0357
Weighted residual factors for significantly intense reflections	0.0897
Weighted residual factors for all reflections included in the refinement	0.0951
Goodness-of-fit parameter for all reflections included in the refinement	1.048
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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