Information card for entry 4319302

Structure parameters

• Chemical name: trans-Dinitro-cisoid-bis(N-tetradecylethylenediamine)cobalt(III) Perchlorate
• Formula: C32 H72 Cl Co N6 O8
• Calculated formula: C32 H72 Cl Co N6 O8
• SMILES: [Co]12([NH2]CC[NH]1CCCCCCCCCCCCCC)([NH2]CC[NH]2CCCCCCCCCCCCCC)(N(=O)=O)N(=O)=O.Cl(=O)(=O)(=O)[O-]
• Title of publication: Synthesis, Structure, and Stereochemistry of Double-Chain Surfactant Co(III) Complexes
• Authors of publication: Navamoney Arulsamy; D. Scott Bohle; Patricia A. Goodson; David A. Jaeger; Ven B. Reddy
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 836 - 842
• a: 6.5754 ± 0.0002 Å
• b: 10.5182 ± 0.0002 Å
• c: 30.4789 ± 0.0003 Å
• α: 98.931 ± 0.002°
• β: 91.678 ± 0.002°
• γ: 97.063 ± 0.002°
• Cell volume: 2064.09 ± 0.08 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2267
• Residual factor for significantly intense reflections: 0.1184
• Weighted residual factors for all reflections: 0.3125
• Weighted residual factors for significantly intense reflections: 0.2506
• Goodness-of-fit parameter for all reflections: 0.965
• Goodness-of-fit parameter for significantly intense reflections: 1.189
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No