Information card for entry 7006091

Structure parameters

• Formula: C28 H21 Au Cr N O5 P
• 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 ų
• 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