Information card for entry 2239043

Structure parameters

• Chemical name: (1-Methyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)(1-methyl-2-nitrosobenzene-κ<i>N</i>)(5,10,15,20-tetraphenylporphyrinato-κ^4^<i>N</i>)iron(II) dichloromethane monosolvate
• Formula: C56 H43 Cl2 Fe N7 O
• Calculated formula: C55 H41 Fe N7 O
• Title of publication: (1-Methyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)(1-methyl-2-nitrosobenzene-κ<i>N</i>)(5,10,15,20-tetraphenylporphyrinato-κ^4^<i>N</i>)iron(II) dichloromethane monosolvate
• Authors of publication: Abucayon, Erwin G.; Awasabisah, Dennis; Powell, Douglas R.; Richter-Addo, George B.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 2
• Pages of publication: m51 - m52
• a: 12.1749 ± 0.0012 Å
• b: 13.4571 ± 0.0013 Å
• c: 15.0439 ± 0.0015 Å
• α: 107.45 ± 0.002°
• β: 94.8 ± 0.002°
• γ: 90.987 ± 0.002°
• Cell volume: 2340.8 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.074
• Residual factor for significantly intense reflections: 0.0564
• Weighted residual factors for significantly intense reflections: 0.1593
• Weighted residual factors for all reflections included in the refinement: 0.1726
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes