Information card for entry 1573327

Structure parameters

• Chemical name: (<i>S</i>,<i>S</i>)-Bis(acetonitrile-κ<i>N</i>)[<i>N</i>,<i>N</i>'-dimethyl-<i>N</i>,<i>N</i>'-bis(pyridin-2-ylmethyl)cyclohexane-1,2-diamine-κ^4^<i>N</i>]iron(II) bis(hexafluoroantimonate)
• Formula: C24 H34 F12 Fe N6 Sb2
• Calculated formula: C24 H34 F12 Fe N6 Sb2
• SMILES: [Sb](F)(F)([F-])(F)(F)F.[Sb](F)(F)(F)([F-])(F)F.[Fe]123([n]4ccccc4C[N]1(C)[C@@H]1CCCC[C@H]1[N]2(C)Cc1[n]3cccc1)([N]#CC)[N]#CC
• Authors of publication: Bibik, Yurii S.; Yulakh, Iryna M.; Shishkina, Svitlana V.; Khomenko, Dmytro M.; Doroshchuk, Roman O.; Raspertova, Ilona V.; Lampeka, Rostyslav D.
• Journal of publication: Acta Crystallographica, Section E: Crystallographic Communications
• Year of publication: 2024
• Journal volume: 80
• Journal issue: 12
• Pages of publication: 1350 - 1353
• a: 11.4949 ± 0.0005 Å
• b: 15.1609 ± 0.0007 Å
• c: 18.5616 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3234.8 ± 0.3 ų
• Cell temperature: 173.15 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0933
• Residual factor for significantly intense reflections: 0.0578
• Weighted residual factors for significantly intense reflections: 0.1073
• Weighted residual factors for all reflections included in the refinement: 0.1199
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No