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Information card for entry 4107062
Preview
Coordinates | 4107062.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H29 F12 N8 O P2 Ru |
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Calculated formula | C30 H26 F12 N7 O P2 Ru |
SMILES | [Ru]123([N](Cc4n(=O)cccc4)(Cc4[n]1cccc4)Cc1[n]2cccc1)([n]1ccccc1c1[n]3cccc1)[N]#CC.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-] |
Title of publication | Photochemical Activation of Ruthenium(II)-Pyridylamine Complexes Having a Pyridine-N-Oxide Pendant toward Oxygenation of Organic Substrates |
Authors of publication | Takahiko Kojima; Kazuya Nakayama; Miyuki Sakaguchi; Takashi Ogura; Kei Ohkubo; Shunichi Fukuzumi |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2011 |
Journal volume | 133 |
Pages of publication | 17901 - 17911 |
a | 19.373 ± 0.003 Å |
b | 8.8414 ± 0.0011 Å |
c | 21.969 ± 0.003 Å |
α | 90° |
β | 114.923 ± 0.0004° |
γ | 90° |
Cell volume | 3412.5 ± 0.8 Å3 |
Cell temperature | 123.1 K |
Number of distinct elements | 7 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for significantly intense reflections | 0.0528 |
Weighted residual factors for all reflections included in the refinement | 0.138 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.107 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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