Information card for entry 7012846

Structure parameters

• Formula: C22 H32 N6
• Calculated formula: C22 H32 N6
• SMILES: N(=C(NCCN(C)C)\C(=N/c1ccccc1)\NCCN(C)C)\c1ccccc1
• Title of publication: Synthesis and characterisation of aluminium and magnesium complexes supported by pendant oxalic amidinate ligands
• Authors of publication: Chen, Chi-Tien; Huang, Chi-An; Tzeng, Yi-Ren; Huang, Bor-Hunn
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 12
• Pages of publication: 2585
• a: 9.594 ± 0.0006 Å
• b: 17.2591 ± 0.0011 Å
• c: 27.7148 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4589.1 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• 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: 0.1078
• Residual factor for significantly intense reflections: 0.0688
• Weighted residual factors for significantly intense reflections: 0.1885
• Weighted residual factors for all reflections included in the refinement: 0.2078
• Goodness-of-fit parameter for all reflections included in the refinement: 1.254
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No