Information card for entry 4085365

Structure parameters

• Formula: C28.5 H40 Au Cl N2
• Calculated formula: C28.5 H40 Au Cl N2
• SMILES: [Au](C#N)=C1N(c2c(C(C)C)cccc2C(C)C)C(CC21C1CC3CC2CC(C1)C3)(C)C.ClCCl
• Title of publication: Gold(I) and Gold(III) Complexes of Cyclic (Alkyl)(amino)carbenes.
• Authors of publication: Romanov, Alexander S.; Bochmann, Manfred
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 11
• Pages of publication: 2439 - 2454
• a: 11.3982 ± 0.0004 Å
• b: 11.7134 ± 0.0005 Å
• c: 20.4073 ± 0.0006 Å
• α: 100.85 ± 0.003°
• β: 97.045 ± 0.004°
• γ: 94.389 ± 0.003°
• Cell volume: 2641.8 ± 0.17 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0343
• Residual factor for significantly intense reflections: 0.0259
• Weighted residual factors for significantly intense reflections: 0.0555
• Weighted residual factors for all reflections included in the refinement: 0.0597
• Goodness-of-fit parameter for all reflections included in the refinement: 0.973
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No