Information card for entry 7041403

Structure parameters

• Chemical name: Dichloro-(O-dimethyl sulfoxide)(N(4)-para-chorophenyl-2-acetylpyridinethiosemicarbazonato)Indium(III) acetonitrile solvate
• Formula: C18 H21 Cl3 In N5 O S2
• Calculated formula: C18 H21 Cl3 In N5 O S2
• Title of publication: Cytotoxic and antimicrobial effects of indium(iii) complexes with 2-acetylpyridine-derived thiosemicarbazones.
• Authors of publication: Oliveira, Alexandre A.; Perdigão, Gabriele M C; Rodrigues, Luana E.; da Silva, Jeferson G.; Souza-Fagundes, Elaine M; Takahashi, Jacqueline A.; Rocha, Willian R.; Beraldo, Heloisa
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 3
• Pages of publication: 918 - 932
• a: 8.8806 ± 0.0002 Å
• b: 11.5497 ± 0.0002 Å
• c: 13.0644 ± 0.0003 Å
• α: 110.3 ± 0.002°
• β: 90.297 ± 0.002°
• γ: 105.723 ± 0.002°
• Cell volume: 1202.42 ± 0.05 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0193
• Residual factor for significantly intense reflections: 0.0167
• Weighted residual factors for significantly intense reflections: 0.0394
• Weighted residual factors for all reflections included in the refinement: 0.0409
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No