Crystallography Open Database

Information card for entry 7044754

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Coordinates	7044754.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H45 B2 F8 N2 P
Calculated formula	C34 H45 B2 F8 N2 P
Title of publication	Dicationic phosphonium salts: Lewis acid initiators for the Mukaiyama-aldol reaction
Authors of publication	Barrado, Alejandro G.; Bayne, Julia M.; Johnstone, Timothy C.; Lehmann, Christian W.; Stephan, Douglas W.; Alcarazo, Manuel
Journal of publication	Dalton Transactions
Year of publication	2017
a	14.2328 ± 0.0007 Å
b	14.804 ± 0.0007 Å
c	16.3008 ± 0.0008 Å
α	90°
β	92.5451 ± 0.0018°
γ	90°
Cell volume	3431.2 ± 0.3 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	6
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0774
Residual factor for significantly intense reflections	0.0768
Weighted residual factors for significantly intense reflections	0.2006
Weighted residual factors for all reflections included in the refinement	0.2017
Goodness-of-fit parameter for all reflections included in the refinement	1.085
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	Cu-Kα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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