Information card for entry 2011501

Structure parameters

• Formula: C24 H66 Cl12 In4 N6
• Calculated formula: C24 H66 Cl12 In4 N6
• SMILES: C(C)[NH](CC)[In]1([Cl][In]2([NH](CC)CC)([Cl]1)(Cl)[Cl][In]1([NH](CC)CC)([Cl][In]([NH](CC)CC)([NH](CC)CC)([Cl]1)(Cl)Cl)(Cl)[Cl]2)(Cl)([NH](CC)CC)Cl
• Title of publication: Tetrameric indium trichloride, a new modification of a widely used compound
• Authors of publication: Müller, Peter; Usón, Isabel; Prust, Jörg; Roesky, Herbert W.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 11
• Pages of publication: 1300 - 1301
• a: 10.962 ± 0.002 Å
• b: 11.407 ± 0.002 Å
• c: 11.674 ± 0.002 Å
• α: 95.46 ± 0.03°
• β: 109.57 ± 0.03°
• γ: 114.2 ± 0.03°
• Cell volume: 1207.8 ± 0.7 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.026
• Residual factor for significantly intense reflections: 0.023
• Weighted residual factors for all reflections included in the refinement: 0.054
• Goodness-of-fit parameter for all reflections included in the refinement: 1.138
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes