Information card for entry 7238745

Structure parameters

• Formula: C46 H81 N2 O2 Zr3
• Calculated formula: C46 H81 N2 O2 Zr3
• Title of publication: Construction of oxygen-bridged multimetallic assembly: dual catalysts for hydroamination reactions
• Authors of publication: Mukherjee, Arup; Sen, Tamal K.; Mandal, Swadhin K.; Maity, Bholanath; Koley, Debasis
• Journal of publication: RSC Adv.
• Year of publication: 2013
• Journal volume: 3
• Journal issue: 4
• Pages of publication: 1255
• a: 14.8729 ± 0.0016 Å
• b: 18.838 ± 0.002 Å
• c: 17.819 ± 0.002 Å
• α: 90°
• β: 111.125 ± 0.002°
• γ: 90°
• Cell volume: 4656.9 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0309
• Residual factor for significantly intense reflections: 0.0238
• Weighted residual factors for significantly intense reflections: 0.0617
• Weighted residual factors for all reflections included in the refinement: 0.0664
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No