Information card for entry 7013711

Structure parameters

• Common name: Chloro(2-pyridineformamide thiosemicarbazonato)gold(iii) chloride
• Chemical name: Chloro(2-pyridineformamide thiosemicarbazonato)gold(III) chloride
• Formula: C9 H16 Au Cl2 N5 O2 S
• Calculated formula: C9 H16 Au Cl2 N5 O2 S
• SMILES: [Au]12([N](=C(c3[n]1cccc3)N)N=C(S2)N)Cl.[Cl-].OC.OC
• Title of publication: Stable gold(III) complexes with thiosemicarbazone derivatives.
• Authors of publication: Santos, Isabel Garcia; Hagenbach, Adelheid; Abram, Ulrich
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 4
• Pages of publication: 677 - 682
• a: 36.752 ± 0.006 Å
• b: 12.413 ± 0.002 Å
• c: 13.958 ± 0.002 Å
• α: 90°
• β: 90.7 ± 0.01°
• γ: 90°
• Cell volume: 6367.2 ± 1.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0287
• Residual factor for significantly intense reflections: 0.0207
• Weighted residual factors for significantly intense reflections: 0.0474
• Weighted residual factors for all reflections included in the refinement: 0.0502
• Goodness-of-fit parameter for all reflections included in the refinement: 0.979
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No