Crystallography Open Database

Information card for entry 4304354

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Structure parameters

Formula	C44 H54 N2 O2 P2
Calculated formula	C44 H54 N2 O2 P2
SMILES	P(=O)(c1ccccc1)(c1ccccc1)C=C(NC(C)(C)C)C.P(=O)(c1ccccc1)(c1ccccc1)C=C(NC(C)(C)C)C.c1ccccc1
Title of publication	Nickel(II) Complexes Containing Bidentate Amido Phosphine Ligands Derived from α-Iminophosphorus Ylides: Synthesis and Structural Characterization
Authors of publication	Pei-Ying Lee; Lan-Chang Liang
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	749 - 758
a	11.3747 ± 0.0003 Å
b	16.4104 ± 0.0004 Å
c	21.976 ± 0.0007 Å
α	90°
β	102.379 ± 0.0011°
γ	90°
Cell volume	4006.74 ± 0.19 Å³
Cell temperature	298 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1298
Residual factor for significantly intense reflections	0.0673
Weighted residual factors for significantly intense reflections	0.1597
Weighted residual factors for all reflections included in the refinement	0.2143
Goodness-of-fit parameter for all reflections included in the refinement	1.177
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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