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Information card for entry 4079944
Preview
Coordinates | 4079944.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C15 H21 F6 N2 P Ru |
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Calculated formula | C15 H21 F6 N2 P Ru |
SMILES | [P](F)(F)(F)(F)(F)[F-].[Ru]123456789([cH]%10[cH]1[cH]2[cH]4[c]5([c]3%10N(C)C)N(C)C)[cH]1[cH]9[cH]6[cH]8[cH]71 |
Title of publication | Preparation and Properties of Cyclopentadienyl Ruthenocenium Complexes with 1,2-Disubstituted Benzene Ligands: Competition between Chelate Coordination and Sandwich Coordination |
Authors of publication | Mori, Shotaro; Mochida, Tomoyuki |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 1 |
Pages of publication | 283 |
a | 8.9716 ± 0.0013 Å |
b | 13.974 ± 0.002 Å |
c | 14.173 ± 0.002 Å |
α | 90° |
β | 99.419 ± 0.002° |
γ | 90° |
Cell volume | 1752.9 ± 0.4 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 6 |
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 | 0.0224 |
Residual factor for significantly intense reflections | 0.0205 |
Weighted residual factors for significantly intense reflections | 0.0518 |
Weighted residual factors for all reflections included in the refinement | 0.0531 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4079944.html
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Users of the data should acknowledge the original authors of the
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