Information card for entry 7124923

Structure parameters

• Chemical name: Zr2-H
• Formula: C72 H83 N2 O2.5 Zr2
• Calculated formula: C72 H83 N2 O2.5 Zr2
• Title of publication: Multifaceted chelating μ-(η(3):η(3)-antifacial)-(cis-C4R2H2) coordination motif in binuclear complexes.
• Authors of publication: Liu, Cham-Chuen; Chan, Michael C. W.; Lo, Po-Kam; Lau, Kai-Chung; Yiu, Shek-Man
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 74
• Pages of publication: 11056 - 11059
• a: 11.3506 ± 0.0003 Å
• b: 15.5365 ± 0.0005 Å
• c: 19.1544 ± 0.0006 Å
• α: 79.469 ± 0.002°
• β: 79.993 ± 0.002°
• γ: 81.353 ± 0.002°
• Cell volume: 3245.81 ± 0.17 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0399
• Residual factor for significantly intense reflections: 0.0377
• Weighted residual factors for significantly intense reflections: 0.1129
• Weighted residual factors for all reflections included in the refinement: 0.1149
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No