Information card for entry 4306787

Structure parameters

• Common name: 2,2'-biphenyldiacetic acid N-methylhydroxylamine cyclic ester
• Chemical name: Dibenzo-8-methyl-8-aza-7-oxa-6,9-dioxocyclodeca-1,3-diene
• Formula: C17 H15 N O3
• Calculated formula: C17 H15 N O3
• SMILES: O=C1ON(C(=O)Cc2c(c3c(C1)cccc3)cccc2)C
• Title of publication: Tetradentate Bis(hydroxamate) and Hydroxamate-Diketonate Ligands and Their Titanium(IV) Complexes
• Authors of publication: Natcharee Kongprakaiwoot; Bruce C. Noll; Seth N. Brown
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 11902 - 11909
• a: 11.2449 ± 0.0003 Å
• b: 15.8005 ± 0.0004 Å
• c: 7.6152 ± 0.0002 Å
• α: 90°
• β: 93.2695 ± 0.0013°
• γ: 90°
• Cell volume: 1350.83 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0414
• Residual factor for significantly intense reflections: 0.0372
• Weighted residual factors for significantly intense reflections: 0.1047
• Weighted residual factors for all reflections included in the refinement: 0.1094
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No