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Information card for entry 4079972
Preview
Coordinates | 4079972.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C38 H35 Cl4 N3 O Ru |
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Calculated formula | C38 H35 Cl4 N3 O Ru |
SMILES | [Ru]123456(Cl)(Oc7n(nc(c7C(=[N]1c1ccccc1)c1cc7ccccc7cc1)C)c1ccccc1)[c]1([cH]2[cH]3[c]4([cH]5[cH]61)C(C)C)C.C(Cl)(Cl)Cl |
Title of publication | Cytotoxicity of Ruthenium‒Arene Complexes Containing β-Ketoamine Ligands |
Authors of publication | Pettinari, Riccardo; Pettinari, Claudio; Marchetti, Fabio; Clavel, Catherine M.; Scopelliti, Rosario; Dyson, Paul J. |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 1 |
Pages of publication | 309 |
a | 11.0725 ± 0.0004 Å |
b | 15.21 ± 0.0005 Å |
c | 21.3541 ± 0.0007 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3596.3 ± 0.2 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0819 |
Residual factor for significantly intense reflections | 0.0549 |
Weighted residual factors for significantly intense reflections | 0.1371 |
Weighted residual factors for all reflections included in the refinement | 0.159 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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