Information card for entry 7001797

Structure parameters

• Formula: C32 H66 N6 O2 Si2 Zr2
• Calculated formula: C32 H66 N6 O2 Si2 Zr2
• SMILES: [c]123[c]4([c]5([c]6([c]1(C)[Zr]13456(N([N]1(C)C)C)(N(C)C)O[Si]([c]13[c]4([c]5([c]6([c]1(C)[Zr]13456(O[Si]2(C)C)(N([N]1(C)C)C)N(C)C)C)C)C)(C)C)C)C)C
• Title of publication: Transformation of hydroxylamide into hydrazide units in the coordination spheres of group 4 metals
• Authors of publication: Willner, Alexander; Neumann, Beate; Stammler, Hans-Georg; Mitzel, Norbert W.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 32
• Pages of publication: 6280 - 6282
• a: 10.2455 ± 0.0002 Å
• b: 14.0552 ± 0.0003 Å
• c: 13.9038 ± 0.0003 Å
• α: 90°
• β: 93.2933 ± 0.0014°
• γ: 90°
• Cell volume: 1998.88 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0377
• Residual factor for significantly intense reflections: 0.0295
• Weighted residual factors for significantly intense reflections: 0.076
• Weighted residual factors for all reflections included in the refinement: 0.0801
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No