Information card for entry 4341732

Structure parameters

• Common name: [CoLN5(H2O)2]Cl2
• Formula: C15 H35 Cl2 Co N5 O6
• Calculated formula: C15 H35 Cl2 Co N5 O6
• SMILES: [Co]1234([n]5c6cccc5C(C)=[N]1CC[NH]4CC[NH]3CC[N]2=C6C)([OH2])[OH2].[Cl-].[Cl-].O.O.O.O
• Title of publication: Field-Induced Slow Magnetic Relaxation in Cobalt(II) Compounds with Pentagonal Bipyramid Geometry.
• Authors of publication: Huang, Xing-Cai; Zhou, Chun; Shao, Dong; Wang, Xin-Yi
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Pages of publication: 141119111055003
• a: 11.1117 ± 0.0009 Å
• b: 8.5888 ± 0.0008 Å
• c: 24.822 ± 0.002 Å
• α: 90°
• β: 95.384 ± 0.002°
• γ: 90°
• Cell volume: 2358.5 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0483
• Residual factor for significantly intense reflections: 0.0336
• Weighted residual factors for significantly intense reflections: 0.0767
• Weighted residual factors for all reflections included in the refinement: 0.0828
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No