Information card for entry 7111496

Structure parameters

• Common name: (5,10,15,20- tetraphenylporphyrinato)(bispiperidine)molybdenum(ii)
• Chemical name: (5,10,15,20-tetraphenylporphyrinato)(bispiperidine)molybdenum(II)
• Formula: C61 H58 Mo N6
• Calculated formula: C61 H57 Mo N6
• Title of publication: The synthesis of isostructural Mo2+ porphyrin and N-confused porphyrin complexes
• Authors of publication: Harvey, John D.; Shaw, Janet L.; Herrick, Richard S.; Ziegler, Christopher J.
• Journal of publication: Chemical Communications
• Year of publication: 2005
• Journal issue: 37
• Pages of publication: 4663 - 4665
• a: 9.9529 ± 0.0009 Å
• b: 11.6864 ± 0.001 Å
• c: 11.9876 ± 0.0011 Å
• α: 112.413 ± 0.001°
• β: 93.904 ± 0.002°
• γ: 103.401 ± 0.001°
• Cell volume: 1234.77 ± 0.19 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0416
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.0875
• Weighted residual factors for all reflections included in the refinement: 0.0895
• 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