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Information card for entry 4348993
Preview
Coordinates | 4348993.cif |
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Original paper (by DOI) | HTML |
Formula | C29 H37 Cl N2 O2 Ru |
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Calculated formula | C29 H37 Cl N2 O2 Ru |
SMILES | [Ru]123456(Cl)(Oc7n(nc(c7C(=[O]1)C1CCCCC1)C)c1ccccc1)[c]1([c]2([c]3([c]4([c]5([c]61C)C)C)C)C)C |
Title of publication | Synthesis, Structure, and Anticancer Activity of Arene-Ruthenium(II) Complexes with Acylpyrazolones Bearing Aliphatic Groups in the Acyl Moiety. |
Authors of publication | Palmucci, Jessica; Marchetti, Fabio; Pettinari, Riccardo; Pettinari, Claudio; Scopelliti, Rosario; Riedel, Tina; Therrien, Bruno; Galindo, Agustin; Dyson, Paul J. |
Journal of publication | Inorganic chemistry |
Year of publication | 2016 |
Journal volume | 55 |
Journal issue | 22 |
Pages of publication | 11770 - 11781 |
a | 21.957 ± 0.004 Å |
b | 8.1318 ± 0.0013 Å |
c | 29.799 ± 0.005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 5320.6 ± 1.6 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 6 |
Space group number | 33 |
Hermann-Mauguin space group symbol | P n a 21 |
Hall space group symbol | P 2c -2n |
Residual factor for all reflections | 0.0676 |
Residual factor for significantly intense reflections | 0.0468 |
Weighted residual factors for significantly intense reflections | 0.0806 |
Weighted residual factors for all reflections included in the refinement | 0.0891 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.108 |
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/4348993.html
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