Information card for entry 4334858

Structure parameters

• Formula: C32 H50 Fe N4
• Calculated formula: C32 H50 Fe N4
• SMILES: C1(c2c(cc(cc2C)C)C)=[N](C(C)C)[Fe]2(N1C(C)C)[N](=C(c1c(cc(cc1C)C)C)N2C(C)C)C(C)C
• Title of publication: Reactivity of a Bis(amidinato)iron(II) Complex [Fe(MesC(NPri)2)2] toward Some Oxidizing Reagents
• Authors of publication: Long Zhang; Li Xiang; Yihua Yu; Liang Deng
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 5906 - 5913
• a: 19.4937 ± 0.0006 Å
• b: 7.9695 ± 0.0003 Å
• c: 21.0687 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3273.13 ± 0.19 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0379
• Residual factor for significantly intense reflections: 0.0322
• Weighted residual factors for significantly intense reflections: 0.0889
• Weighted residual factors for all reflections included in the refinement: 0.0962
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No