Crystallography Open Database

Information card for entry 4301964

4301963 << 4301964 >> 4301965

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Coordinates	4301964.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H36 Cl N P2 Pd
Calculated formula	C16 H36 Cl N P2 Pd
SMILES	[Pd]12(Cl)[P](CCN2CC[P]1(C(C)C)C(C)C)(C(C)C)C(C)C
Title of publication	Palladium N(CH2CH2PiPr2)2-Dialkylamides: Synthesis, Structural Characterization, and Reactivity
Authors of publication	Alexander N. Marziale; Eberhardt Herdtweck; Jörg Eppinger; Sven Schneider
Journal of publication	Inorganic Chemistry
Year of publication	2009
Journal volume	48
Pages of publication	3699 - 3709
a	8.5012 ± 0.0004 Å
b	11.6523 ± 0.0007 Å
c	21.1295 ± 0.001 Å
α	90°
β	90.537 ± 0.004°
γ	90°
Cell volume	2092.97 ± 0.19 Å³
Cell temperature	173 ± 1 K
Ambient diffraction temperature	173 ± 1 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	0.0293
Residual factor for significantly intense reflections	0.0241
Weighted residual factors for significantly intense reflections	0.0655
Weighted residual factors for all reflections included in the refinement	0.0664
Goodness-of-fit parameter for all reflections included in the refinement	1.011
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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