Information card for entry 4000903

Structure parameters

• Formula: C17 H25 Al N4
• Calculated formula: C17 H25 Al N4
• SMILES: CC([N]1=Cc2n([Al]31(C)[N](=Cc1n3ccc1)C(C)C)ccc2)C
• Title of publication: Solution Reactions of a Bis(pyrrolylaldiminate)copper(II) Complex with Peralkyl Zinc, Aluminum, and Boron Reagents: Investigation of the Pathways Responsible for Copper Metal Deposition
• Authors of publication: Vidjayacoumar, Balamurugan; Emslie, David J. H.; Blackwell, James M.; Clendenning, Scott B.; Britten, James F.
• Journal of publication: Chemistry of Materials
• Year of publication: 2010
• Journal volume: 22
• Journal issue: 17
• Pages of publication: 4854
• a: 23.1805 ± 0.0003 Å
• b: 9.2975 ± 0.0001 Å
• c: 16.7106 ± 0.0002 Å
• α: 90°
• β: 100.235 ± 0.001°
• γ: 90°
• Cell volume: 3544.17 ± 0.07 ų
• Cell temperature: 96 ± 2 K
• Ambient diffraction temperature: 96 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0573
• Residual factor for significantly intense reflections: 0.0505
• Weighted residual factors for significantly intense reflections: 0.1403
• Weighted residual factors for all reflections included in the refinement: 0.1464
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No