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Information card for entry 7006091
Preview
Coordinates | 7006091.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C28 H21 Au Cr N O5 P |
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Calculated formula | C28 H21 Au Cr N O5 P |
SMILES | [Au]([P](c1ccccc1)(c1ccccc1)c1ccccc1)=C(N(C)C)C#C[Cr](C#[O])(C#[O])(C#[O])(C#[O])C#[O] |
Title of publication | Reaction and subsequent transformation of anionic acetylide-carbene complexes using the Ph3PAu+ fragment. |
Authors of publication | Stander, Elzet; Esterhuysen, Catharine; McKenzie, Jean M.; Cronje, Stephanie; Raubenheimer, Helgard G. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2007 |
Journal issue | 48 |
Pages of publication | 5684 - 5691 |
a | 10.364 ± 0.003 Å |
b | 11.566 ± 0.003 Å |
c | 12.463 ± 0.004 Å |
α | 74.216 ± 0.014° |
β | 69.976 ± 0.005° |
γ | 82.605 ± 0.008° |
Cell volume | 1349.7 ± 0.7 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1156 |
Residual factor for significantly intense reflections | 0.0788 |
Weighted residual factors for significantly intense reflections | 0.1648 |
Weighted residual factors for all reflections included in the refinement | 0.1808 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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