Information card for entry 2210305

Structure parameters

• Formula: C23 H34 Cl Co N4 O4
• Calculated formula: C23 H34 Cl Co N4 O4
• SMILES: [Co]12345[N](CC[N]1=C(c1c(O4)cccc1)C)(CC[N]2=C(c1c(O5)cccc1)C)CC[NH2]3.[Cl-].OC.O
• Title of publication: (<i>N</i>,<i>N</i>'-Bis{[1-(2-oxidophenyl)ethylene]aminoethyl}ethylenediamine)cobalt(III) chloride methanol solvate hydrate
• Authors of publication: Hai-Ying Fu; Jian-Min Dou; Da-Cheng Li; Da-Qi Wang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: m2213 - m2215
• a: 14.875 ± 0.005 Å
• b: 11.708 ± 0.004 Å
• c: 14.04 ± 0.005 Å
• α: 90°
• β: 97.11 ± 0.005°
• γ: 90°
• Cell volume: 2426.4 ± 1.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0744
• Residual factor for significantly intense reflections: 0.0505
• Weighted residual factors for significantly intense reflections: 0.135
• Weighted residual factors for all reflections included in the refinement: 0.1577
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes