Information card for entry 7206110

Structure parameters

• Common name: (Methanol)cis-dioxo(N-3-methoxysalicylidene-2-amino-3 - hydroxypyridine)molybdenum(VI)
• Chemical name: (Methanol)cis-dioxo(N-3-methoxysalicylidene-2-amino-3 -hydroxypyridine)molybdenum(VI)
• Formula: C14 H14 Mo N2 O6
• Calculated formula: C14 H14 Mo N2 O6
• SMILES: [Mo]12(=O)(=O)(Oc3c(nccc3)[N]2=Cc2c(O1)c(OC)ccc2)[OH]C
• Title of publication: Mechanosensitive metal‒ligand bonds in the design of new coordination compounds
• Authors of publication: Užarević, Krunoslav; Rubčić, Mirta; Radić, Maja; Puškarić, Andreas; Cindrić, Marina
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 13
• Pages of publication: 4314
• a: 8.189 ± 0.0007 Å
• b: 10.9898 ± 0.0009 Å
• c: 17.93 ± 0.002 Å
• α: 90°
• β: 105.346 ± 0.009°
• γ: 90°
• Cell volume: 1556.1 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• 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: 0.0357
• Residual factor for significantly intense reflections: 0.024
• Weighted residual factors for significantly intense reflections: 0.0593
• Weighted residual factors for all reflections included in the refinement: 0.0616
• Goodness-of-fit parameter for all reflections included in the refinement: 0.923
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No