Information card for entry 4310556

Structure parameters

• Common name: (iPr-L-Xan)Al2Me4 (4)
• Formula: C33 H52 Al2 N4 O
• Calculated formula: C33 H52 Al2 N4 O
• SMILES: [Al]1([N](C(C)C)=C(N1C(C)C)c1cccc2c1Oc1c(C2(C)C)cccc1C1=[N]([Al](N1C(C)C)(C)C)C(C)C)(C)C
• Title of publication: Synthesis and Characterization of Binucleating Bis(amidinate) Ligands and Their Dialuminum Complexes
• Authors of publication: Bronya Clare; Niladri Sarker; Richard Shoemaker; John R. Hagadorn
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 1159 - 1166
• a: 21.1468 ± 0.0013 Å
• b: 11.5004 ± 0.0007 Å
• c: 29.858 ± 0.0017 Å
• α: 90°
• β: 97.293 ± 0.001°
• γ: 90°
• Cell volume: 7202.6 ± 0.7 ų
• Cell temperature: 136 ± 2 K
• Ambient diffraction temperature: 136 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0662
• Residual factor for significantly intense reflections: 0.0448
• Weighted residual factors for significantly intense reflections: 0.1115
• Weighted residual factors for all reflections included in the refinement: 0.1202
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No