Information card for entry 4101432

Structure parameters

• Formula: C45 H53 Al N2
• Calculated formula: C45 H53 Al N2
• Title of publication: Aluminacyclopropene: syntheses, characterization, and reactivity toward terminal alkynes.
• Authors of publication: Zhu, Hongping; Oswald, Rainer B; Fan, Hongjun; Roesky, Herbert W; Ma, Qingjun; Yang, Zhi; Schmidt, Hans-Georg; Noltemeyer, Mathias; Starke, Kerstin; Hosmane, Narayan S
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Journal issue: 15
• Pages of publication: 5100 - 5108
• a: 11.118 ± 0.002 Å
• b: 12.44 ± 0.003 Å
• c: 15.279 ± 0.003 Å
• α: 73.57 ± 0.03°
• β: 75.6 ± 0.03°
• γ: 72.74 ± 0.03°
• Cell volume: 1904.2 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0818
• Residual factor for significantly intense reflections: 0.0736
• Weighted residual factors for significantly intense reflections: 0.1508
• Weighted residual factors for all reflections included in the refinement: 0.1549
• Goodness-of-fit parameter for all reflections included in the refinement: 1.232
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No