Information card for entry 7226314

Structure parameters

• Formula: C26 H35 N3
• Calculated formula: C26 H35 N3
• SMILES: [nH]1c(ccc1/C=N/C12CC3CC(C1)CC(C3)C2)/C=N/C12CC3CC(C2)CC(C1)C3
• Title of publication: Alkali Metal Complexes Having Sterically Bulky Bis-Iminopyrrolyl Ligands ‒ Control of Dimeric to Monomeric Complex
• Authors of publication: Panda, Tarun Kanti Kanti; Anga, Srinivas; Banerjee, Indrani; Nayek, Hari Pada
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 25.4797 ± 0.0019 Å
• b: 6.8484 ± 0.0004 Å
• c: 27.753 ± 0.002 Å
• α: 90°
• β: 112.294 ± 0.008°
• γ: 90°
• Cell volume: 4480.8 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• 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: 0.1128
• Residual factor for significantly intense reflections: 0.0855
• Weighted residual factors for significantly intense reflections: 0.2789
• Weighted residual factors for all reflections included in the refinement: 0.3061
• Goodness-of-fit parameter for all reflections included in the refinement: 0.936
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No