Crystallography Open Database

Information card for entry 4115036

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Coordinates	4115036.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H28 N P Pd
Calculated formula	C25 H28 N P Pd
Title of publication	Synthesis, Characterization, and Reactivity of Arylpalladium Cyanoalkyl Complexes: Selection of Catalysts for the α-Arylation of Nitriles
Authors of publication	Darcy A. Culkin; John F. Hartwig
Journal of publication	Journal of the American Chemical Society
Year of publication	2002
Journal volume	124
Pages of publication	9330 - 9331
a	29.992 ± 0.001 Å
b	8.635 ± 0.0003 Å
c	17.599 ± 0.001 Å
α	90°
β	94.839 ± 0.002°
γ	90°
Cell volume	4541.6 ± 0.3 Å³
Cell temperature	183.2 K
Ambient diffraction temperature	183.2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for significantly intense reflections	0.0308
Weighted residual factors for significantly intense reflections	0.0309
Goodness-of-fit parameter for significantly intense reflections	1.568
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKalpha
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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