Information card for entry 7106707

Structure parameters

• Formula: C43 H30.74 N6 O1.37
• Calculated formula: C43 H30.735 N6 O1.367
• Title of publication: Porpholactams and chlorolactams: Replacement of a b,b'-double bond in meso-tetraphenyl-porphyrin and -chlorin by a lactam moiety
• Authors of publication: Joshua Akhigbe; John Haskoor; Matthias Zeller; Christian Bruckner
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 8599
• a: 11.737 ± 0.004 Å
• b: 12.257 ± 0.004 Å
• c: 13.154 ± 0.004 Å
• α: 76.707 ± 0.004°
• β: 78.36 ± 0.004°
• γ: 65.649 ± 0.004°
• Cell volume: 1665.5 ± 0.9 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: 0.1432
• Residual factor for significantly intense reflections: 0.0861
• Weighted residual factors for significantly intense reflections: 0.2284
• Weighted residual factors for all reflections included in the refinement: 0.2608
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No