Information card for entry 7007265

Structure parameters

• Formula: C18 H32 Au Cl N4
• Calculated formula: C18 H32 Au Cl N4
• SMILES: [Au](=C1N(C=CN1C(C)C)C(C)C)=C1N(C=CN1C(C)C)C(C)C.[Cl-]
• Title of publication: Cationic, linear Au(I) N-heterocyclic carbene complexes: synthesis, structure and anti-mitochondrial activity.
• Authors of publication: Baker, Murray V.; Barnard, Peter J.; Berners-Price, Susan J; Brayshaw, Simon K.; Hickey, James L.; Skelton, Brian W.; White, Allan H.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 30
• Pages of publication: 3708 - 3715
• a: 10.692 ± 0.002 Å
• b: 10.855 ± 0.002 Å
• c: 10.818 ± 0.002 Å
• α: 90°
• β: 118.252 ± 0.002°
• γ: 90°
• Cell volume: 1106 ± 0.4 ų
• Cell temperature: 170 K
• Ambient diffraction temperature: 170 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.026
• Residual factor for significantly intense reflections: 0.017
• Weighted residual factors for significantly intense reflections: 0.037
• Weighted residual factors for all reflections included in the refinement: 0.047
• Goodness-of-fit parameter for significantly intense reflections: 0.96
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No