Information card for entry 4318389

Structure parameters

• Formula: C28 H23 Cl2 Cr N7
• Calculated formula: C28 H23 Cl2 Cr N7
• SMILES: [Cr]12(Cl)(Cl)([n]3ccccc3N=[N]1c1ccccc1)[n]1ccccc1N=[N]2c1ccc(Nc2ccccc2)cc1
• Title of publication: Chromium Complexes of an Isomeric N-Donor Ligand, 2-[(N-Arylamino)phenylazo]pyridine: Amination Reactions, X-ray Structure, and Redox Properties
• Authors of publication: Kunal K. Kamar; Amrita Saha; Alfonso Castiñeiras; Chen-Hsiung Hung; Sreebrata Goswami
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 4531 - 4538
• a: 28.666 ± 0.002 Å
• b: 11.8843 ± 0.0003 Å
• c: 17.5429 ± 0.001 Å
• α: 90°
• β: 107.729 ± 0.004°
• γ: 90°
• Cell volume: 5692.6 ± 0.5 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 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: 0.1248
• Residual factor for significantly intense reflections: 0.0613
• Weighted residual factors for significantly intense reflections: 0.1546
• Weighted residual factors for all reflections included in the refinement: 0.1858
• Goodness-of-fit parameter for all reflections included in the refinement: 0.872
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No