Information card for entry 7013562

Structure parameters

• Common name: Ti4(u-DHP)2(u-OPri)4(OPri)8
• Formula: C44 H88 N4 O16 Ti4
• Calculated formula: C44 H88 N4 O16 Ti4
• Title of publication: 4,6-Dihydroxypyrimidine: a selective bridging ligand for controlled Group IV metal alkoxide structures
• Authors of publication: Boyle, Timothy J.; Rodriguez, Mark A.; Alam, Todd M.
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 24
• Pages of publication: 4598
• a: 11.732 ± 0.005 Å
• b: 15.003 ± 0.006 Å
• c: 17.776 ± 0.007 Å
• α: 96.204 ± 0.006°
• β: 98.401 ± 0.006°
• γ: 103.87 ± 0.006°
• Cell volume: 2971 ± 2 ų
• Cell temperature: 168 ± 2 K
• Ambient diffraction temperature: 168 ± 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: 0.0769
• Residual factor for significantly intense reflections: 0.0594
• Weighted residual factors for significantly intense reflections: 0.1449
• Weighted residual factors for all reflections included in the refinement: 0.1555
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No