Information card for entry 7209030

Structure parameters

• Formula: C11 H9 N3 O
• Calculated formula: C11 H9 N3 O
• SMILES: c1c(cccn1)C(=NO)c1ccccn1
• Title of publication: Triflate anion and ligand influences in silver(i) coordination polymers of four isomeric dipyridyl ketone oximes
• Authors of publication: Argyle, Victoria J.; Woods, Laura M.; Roxburgh, Marina; Hanton, Lyall R.
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 1
• Pages of publication: 120
• a: 9.1149 ± 0.0002 Å
• b: 10.1937 ± 0.0002 Å
• c: 10.128 ± 0.0002 Å
• α: 90°
• β: 91.9285 ± 0.0012°
• γ: 90°
• Cell volume: 940.51 ± 0.03 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 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: 0.0326
• Residual factor for significantly intense reflections: 0.0307
• Weighted residual factors for significantly intense reflections: 0.0771
• Weighted residual factors for all reflections included in the refinement: 0.0789
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No