Information card for entry 7027343

Structure parameters

• Formula: C32 H76 N4 O8 Zr2
• Calculated formula: C32 H76 N4 O8 Zr2
• Title of publication: Zirconium mixed ligand isopropoxide/aminoalkoxide complexes: crystal structures of [Zr2(OPri)6(L)2] and [Zr2(OBut)3(bdmap)4(OH)] {where L = dmap, 1-dimethylaminopropan-2-olate and bdmap, 1,1-bis(dimethylamino)propan-2-olate}
• Authors of publication: Fleeting, Kirsty A.; O’Brien, Paul; Jones, Anthony C.; Otway, David J.; White, Andrew J. P.; Williams, David J.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 16
• Pages of publication: 2853
• a: 22.066 ± 0.0015 Å
• b: 12.3385 ± 0.0009 Å
• c: 32.591 ± 0.003 Å
• α: 90°
• β: 101.162 ± 0.007°
• γ: 90°
• Cell volume: 8705.4 ± 1.2 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 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: 0.0694
• Residual factor for significantly intense reflections: 0.0537
• Weighted residual factors for all reflections: 0.148
• Weighted residual factors for significantly intense reflections: 0.1363
• Goodness-of-fit parameter for all reflections: 1.054
• Goodness-of-fit parameter for significantly intense reflections: 1.098
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No