Information card for entry 4309214

Structure parameters

• Formula: C14 H28 Br In N2
• Calculated formula: C14 H28 Br In N2
• SMILES: C1CC2CC[N]1([InH2](Br)[N]13CCC(CC1)CC3)CC2
• Title of publication: Controlled Decomposition of an Indium Trihydride Adduct: Synthesis and Characterization of the First Mixed-Oxidation-State Indium Sub-halide Complex Anion, [In5Br8(quinuclidine)4]-
• Authors of publication: Marcus L. Cole; Cameron Jones; Marc Kloth
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 4909 - 4911
• a: 11.215 ± 0.002 Å
• b: 12.033 ± 0.002 Å
• c: 12.634 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1705 ± 0.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0562
• Residual factor for significantly intense reflections: 0.0321
• Weighted residual factors for significantly intense reflections: 0.0623
• Weighted residual factors for all reflections included in the refinement: 0.0705
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No