Information card for entry 7053974

Structure parameters

• Common name: Compound 17
• Formula: C28 H38 Cl5 In N2 O2
• Calculated formula: C28 H38 Cl5 In N2 O2
• Title of publication: 1,4-Dialkyl-1,4-diazabutadienes: their reactions with aluminum and indium halides
• Authors of publication: Rojas-Sáenz, Héctor; Suárez-Moreno, Galdina V.; Ramos-García, Iris; Duarte-Hernández, Angélica M.; Mijangos, Edgar; Peña-Hueso, Adrián; Contreras, Rosalinda; Flores-Parra, Angelina
• Journal of publication: New Journal of Chemistry
• Year of publication: 2014
• Journal volume: 38
• Journal issue: 1
• Pages of publication: 391
• a: 6.9619 ± 0.0002 Å
• b: 13.4095 ± 0.0005 Å
• c: 35.1631 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3282.67 ± 0.18 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1719
• Residual factor for significantly intense reflections: 0.0707
• Weighted residual factors for significantly intense reflections: 0.1152
• Weighted residual factors for all reflections included in the refinement: 0.1444
• Goodness-of-fit parameter for all reflections included in the refinement: 0.994
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No