Crystallography Open Database

Information card for entry 7013279

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Coordinates	7013279.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C64 H71 Cl N2 P2 Pd
Calculated formula	C64 H71 Cl N2 P2 Pd
SMILES	[Pd]1(Cl)([N](c2c(cccc2C(C)C)C(C)C)=P(c2ccccc2)(c2ccccc2)C1C(=N\c1c(cccc1C(C)C)C(C)C)\C)P(c1ccccc1)(c1ccccc1)c1ccccc1.c1(ccccc1)C
Title of publication	Nickel and palladium phosphinimine-imine ligand complexes
Authors of publication	Masuda, Jason D.; Wei, Pingrong; Stephan, Douglas W.
Journal of publication	Dalton Transactions
Year of publication	2003
Journal issue	18
Pages of publication	3500
a	10.367 ± 0.007 Å
b	26.477 ± 0.017 Å
c	23.41 ± 0.015 Å
α	90°
β	96.274 ± 0.013°
γ	90°
Cell volume	6387 ± 7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0856
Residual factor for significantly intense reflections	0.0541
Weighted residual factors for significantly intense reflections	0.1415
Weighted residual factors for all reflections included in the refinement	0.1475
Goodness-of-fit parameter for all reflections included in the refinement	1.098
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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