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Information card for entry 4065379
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Coordinates | 4065379.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | 2a-1464 (ON-Ph) (2a) |
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Chemical name | (2-Pyridylamino)diphenylphosphinoxide |
Formula | C17 H15 N2 O P |
Calculated formula | C17 H15 N2 O P |
SMILES | P(=O)(Nc1ncccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Synthesis, Structure, Ligand Dynamics, and Catalytic Activity of Cationic [Pd(η3-allyl)(κ2(E,N)-EN-chelate)]+(E = P, O, S, Se) Complexes |
Authors of publication | Bichler, Bernhard; Veiros, Luis F.; Öztopcu, Özgür; Puchberger, Michael; Mereiter, Kurt; Matsubara, Kouki; Kirchner, Karl A. |
Journal of publication | Organometallics |
Year of publication | 2011 |
Journal volume | 30 |
Journal issue | 21 |
Pages of publication | 5928 |
a | 11.9613 ± 0.0004 Å |
b | 12.9113 ± 0.0005 Å |
c | 18.9275 ± 0.0007 Å |
α | 90° |
β | 91.215 ± 0.002° |
γ | 90° |
Cell volume | 2922.43 ± 0.18 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 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 | 0.0432 |
Residual factor for significantly intense reflections | 0.0372 |
Weighted residual factors for significantly intense reflections | 0.0958 |
Weighted residual factors for all reflections included in the refinement | 0.1013 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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