Information card for entry 4304183

Structure parameters

• Formula: C68 H51 Cl4 Co2 N19 O6 Zn2
• Calculated formula: C68 H51 Cl4 Co2 N19 O6 Zn2
• Title of publication: Cobalt Coordination Induced Functionalized Molecular Clefts: Isolation of {CoIII-ZnII} Heterometallic Complexes and Their Applications in Beckmann Rearrangement Reactions
• Authors of publication: Anurag Mishra; Afsar Ali; Shailesh Upreti; Rajeev Gupta
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 154 - 161
• a: 31.283 ± 0.003 Å
• b: 14.2505 ± 0.0013 Å
• c: 22.139 ± 0.002 Å
• α: 90°
• β: 129.837 ± 0.001°
• γ: 90°
• Cell volume: 7578.5 ± 1.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• 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: 0.093
• Residual factor for significantly intense reflections: 0.0784
• Weighted residual factors for significantly intense reflections: 0.2082
• Weighted residual factors for all reflections included in the refinement: 0.2225
• Goodness-of-fit parameter for all reflections included in the refinement: 1.194
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No