Information card for entry 7014324

Structure parameters

• Formula: C30 H62 N6 O8 Zr2
• Calculated formula: C30 H62 N6 O8 Zr2
• Title of publication: Oximate-substituted zirconium alkoxides.
• Authors of publication: Baumann, Stefan O.; Puchberger, Michael; Schubert, Ulrich
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 6
• Pages of publication: 1401 - 1406
• a: 14.545 ± 0.002 Å
• b: 18.251 ± 0.003 Å
• c: 15.208 ± 0.002 Å
• α: 90°
• β: 101.557 ± 0.002°
• γ: 90°
• Cell volume: 3955.3 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0573
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.1141
• Weighted residual factors for all reflections included in the refinement: 0.1223
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No