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Information card for entry 7027654
Preview
Coordinates | 7027654.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C94 H86 O2 P4 Ru2 |
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Calculated formula | C94 H86 O2 P4 Ru2 |
SMILES | [Ru]1234([P](c5ccccc5)(c5ccccc5)c5ccccc5)([P](c5ccccc5)(c5ccccc5)c5ccccc5)([cH]5[cH]1[cH]2[cH]3[cH]45)C#CC#C[Ru]1234([P](c5ccccc5)(c5ccccc5)c5ccccc5)([P](c5ccccc5)(c5ccccc5)c5ccccc5)[cH]5[cH]1[cH]2[cH]3[cH]45.O1CCCC1.O1CCCC1 |
Title of publication | An efficient synthesis of polyynyl and polyynediyl complexes of ruthenium(II) † |
Authors of publication | Bruce, Michael I.; Hall, Ben C.; Kelly, Brian D.; Low, Paul J.; Skelton, Brian W.; White, Allan H. |
Journal of publication | Journal of the Chemical Society, Dalton Transactions |
Year of publication | 1999 |
Journal issue | 21 |
Pages of publication | 3719 |
a | 23.514 ± 0.01 Å |
b | 14.71 ± 0.009 Å |
c | 25.874 ± 0.009 Å |
α | 90° |
β | 118.11 ± 0.03° |
γ | 90° |
Cell volume | 7894 ± 7 Å3 |
Cell temperature | 293 K |
Ambient diffraction temperature | 293 K |
Number of distinct elements | 5 |
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 | 0.15 |
Residual factor for significantly intense reflections | 0.083 |
Weighted residual factors for all reflections | 0.09 |
Weighted residual factors for all reflections included in the refinement | 0.083 |
Goodness-of-fit parameter for all reflections | 2.135 |
Goodness-of-fit parameter for all reflections included in the refinement | 2.967 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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