Crystallography Open Database

Information card for entry 7100437

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Coordinates	7100437.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H51 B F5 N O2 P2 Pd
Calculated formula	C48 H51 B F5 N O2 P2 Pd
SMILES	C(CC)CC.[Pd]1([P](c2ccccc2C2OC[C@H]([N]1=2)C(C)C)(c1ccccc1)c1ccccc1)([P@@](c1ccccc1)(c1ccccc1OC)[BH3])c1c(F)c(F)c(F)c(F)c1F
Title of publication	Palladium catalysed enantioselective phosphination reactions using secondary phosphine-boranes and aryl iodide
Authors of publication	Annie-Claude Gaumont; Stephanie Pican
Journal of publication	Chemical Communications
Year of publication	2005
a	11.9662 ± 0.0003 Å
b	11.9662 ± 0.0003 Å
c	26.4783 ± 0.0005 Å
α	90°
β	90°
γ	120°
Cell volume	3283.47 ± 0.13 Å³
Cell temperature	120 ± 1 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	8
Space group number	145
Hermann-Mauguin space group symbol	P 32
Hall space group symbol	P 32
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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