Information card for entry 7711199

Structure parameters

• Common name: mer-[InCl3(3,5-Me2-pzH)3(H2O)]
• Chemical name: InCl3(N2C5H8)3(H2O)
• Formula: C15 H25 Cl3 In N6 O0.5
• Calculated formula: C15 H25 Cl3 In N6 O0.5
• Title of publication: Mononuclear, hexanuclear and polymeric indium(iii) pyrazolido complexes; structural characterization, dynamic solution studies and luminescent properties
• Authors of publication: Herrera, Susana; Rivero, Kennett I.; Guzmán, Alexis; Cedeño, Jonathan; Miksovska, Jaroslava; Raptis, Raphael G.
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 9.3323 ± 0.0019 Å
• b: 16.936 ± 0.003 Å
• c: 13.806 ± 0.003 Å
• α: 90°
• β: 92.046 ± 0.005°
• γ: 90°
• Cell volume: 2180.7 ± 0.8 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 6
• 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: 0.0631
• Residual factor for significantly intense reflections: 0.0437
• Weighted residual factors for significantly intense reflections: 0.0851
• Weighted residual factors for all reflections included in the refinement: 0.0914
• Goodness-of-fit parameter for all reflections included in the refinement: 1.121
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No