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Information card for entry 4084935
Preview
Coordinates | 4084935.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C31 H44 Cl8 N4 O2 Pd |
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Calculated formula | C31 H44 Cl8 N4 O2 Pd |
SMILES | c1(c(cccc1C(=O)N(C)C)C(C)C)[N]1=C(C(C)=[N]([Pd]1(Cl)Cl)c1c(cccc1C(=O)N(C)C)C(C)C)C.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl |
Title of publication | Hydrogen Bonding Behavior of Amide-Functionalized α-Diimine Palladium Complexes |
Authors of publication | Zhai, Feng; Jordan, Richard F. |
Journal of publication | Organometallics |
Year of publication | 2014 |
Journal volume | 33 |
Journal issue | 24 |
Pages of publication | 7176 |
a | 20.407 ± 0.007 Å |
b | 11.594 ± 0.004 Å |
c | 17.802 ± 0.006 Å |
α | 90° |
β | 110.72 ± 0.006° |
γ | 90° |
Cell volume | 3940 ± 2 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 6 |
Space group number | 13 |
Hermann-Mauguin space group symbol | P 1 2/c 1 |
Hall space group symbol | -P 2yc |
Residual factor for all reflections | 0.0913 |
Residual factor for significantly intense reflections | 0.0614 |
Weighted residual factors for significantly intense reflections | 0.1371 |
Weighted residual factors for all reflections included in the refinement | 0.1464 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.988 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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