Information card for entry 7124614

Structure parameters

• Formula: C35 H44 Cl2 Co N4 O4
• Calculated formula: C35 H44 Cl2 Co N4 O4
• Title of publication: Propentdyopent: the scaffold of a heme metabolite as an electron reservoir in transition metal complexes.
• Authors of publication: Gautam, R.; Chang, T. M.; Astashkin, A. V.; Lincoln, K. M.; Tomat, E.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 39
• Pages of publication: 6585 - 6588
• a: 17.3525 ± 0.0011 Å
• b: 13.834 ± 0.0009 Å
• c: 14.8976 ± 0.0009 Å
• α: 90°
• β: 102.894 ± 0.003°
• γ: 90°
• Cell volume: 3486.1 ± 0.4 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0755
• Residual factor for significantly intense reflections: 0.0476
• Weighted residual factors for significantly intense reflections: 0.1055
• Weighted residual factors for all reflections included in the refinement: 0.116
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No