Information card for entry 7009114

Structure parameters

• Common name: [Au(Hdamp-C1)Cl(H2pydoxmetsc)l]Cl2*MeOH
• Chemical name: [Au(Hdamp-C1)Cl(H2pydoxmetsc)C]Cl2*MeOH
• Formula: C20 H31 Au Cl3 N5 O3 S
• Calculated formula: C20 H31 Au Cl3 N5 O3 S
• SMILES: [Au]1([N](N=C(S1)NC)=Cc1c(c([nH+]cc1CO)C)O)(Cl)c1ccccc1C[NH+](C)C.[Cl-].[Cl-].CO
• Title of publication: Gold complexes with thiosemicarbazones: reactions of bi- and tridentate thiosemicarbazones with dichloro[2-(dimethylaminomethyl)phenyl-C 1,N ]gold(III), [Au(damp-C 1,N )Cl2]
• Authors of publication: Abram, Ulrich; Ortner, Kirstin; Gust, Ronald; Sommer, Klaus
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 5
• Pages of publication: 735
• a: 9.736 ± 0.002 Å
• b: 11.18 ± 0.001 Å
• c: 13.085 ± 0.002 Å
• α: 77.352 ± 0.007°
• β: 84.752 ± 0.009°
• γ: 82.996 ± 0.007°
• Cell volume: 1376.3 ± 0.4 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 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: 0.062
• Residual factor for significantly intense reflections: 0.0613
• Weighted residual factors for significantly intense reflections: 0.1234
• Weighted residual factors for all reflections included in the refinement: 0.1238
• Goodness-of-fit parameter for all reflections included in the refinement: 1.27
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No