Information card for entry 4339868

Structure parameters

• Formula: C36 H46 Co N4
• Calculated formula: C36 H46 Co N4
• SMILES: c1ccc2C(C)=[N](c3c(cccc3C(C)C)C(C)C)[Co]3(n12)n1cccc1C(C)=[N]3c1c(cccc1C(C)C)C(C)C
• Title of publication: Synthesis and characterization of tetrahedral and square planar Bis(iminopyrrolyl) complexes of cobalt(II).
• Authors of publication: Carabineiro, Sónia A; Silva, Leonel C.; Gomes, Pedro T.; Pereira, Laura C. J.; Veiros, Luís F; Pascu, Sofia I.; Duarte, M. Teresa; Namorado, Sónia; Henriques, Rui T.
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 17
• Pages of publication: 6880 - 6890
• a: 8.1966 ± 0.0014 Å
• b: 9.0582 ± 0.0016 Å
• c: 11.615 ± 0.002 Å
• α: 69.06 ± 0.002°
• β: 79.503 ± 0.002°
• γ: 80.932 ± 0.002°
• Cell volume: 787.9 ± 0.2 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.0682
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for all reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.0419
• Weighted residual factors for all reflections included in the refinement: 0.0419
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1132
• Diffraction radiation wavelength: 0.6814 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No