Crystallography Open Database

Information card for entry 7038428

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Coordinates	7038428.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41.5 H17 B Cl F20 Fe P
Calculated formula	C41.5 H17 B Cl F20 Fe P
Title of publication	Ferrocenyl-derived electrophilic phosphonium cations (EPCs) as Lewis acid catalysts.
Authors of publication	Mallov, Ian; Stephan, Douglas W.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	13
Pages of publication	5568 - 5574
a	9.2968 ± 0.0019 Å
b	12.614 ± 0.003 Å
c	17.635 ± 0.004 Å
α	92.82 ± 0.011°
β	95.745 ± 0.009°
γ	110.566 ± 0.008°
Cell volume	1918.6 ± 0.8 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150.05 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	0.1363
Residual factor for significantly intense reflections	0.0557
Weighted residual factors for significantly intense reflections	0.0754
Weighted residual factors for all reflections included in the refinement	0.1029
Goodness-of-fit parameter for all reflections included in the refinement	0.9571
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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