Information card for entry 7003106

Structure parameters

• Formula: C96 H124 Cu6 N6 O31 Ti4
• Calculated formula: C96 H124 Cu6 N6 O31 Ti4
• Title of publication: Single source heterobimetallic precursors for the deposition of Cu‒Ti mixed metal oxide thin films
• Authors of publication: Tahir, Asif Ali; Hamid, Mazhar; Mazhar, Muhammad; Zeller, Matthias; Hunter, Allen D.; Nadeem, Muhammad; Akhtar, Muhammad Javed
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 9
• Pages of publication: 1224 - 1232
• a: 19.6795 ± 0.0006 Å
• b: 19.6795 ± 0.0006 Å
• c: 50.516 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 16942.9 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0567
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.1237
• Weighted residual factors for all reflections included in the refinement: 0.1383
• Goodness-of-fit parameter for all reflections included in the refinement: 1.127
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No