Information card for entry 4506172

Structure parameters

• Common name: Tl(3PCO)
• Chemical name: Thallium(I) 3-pyridylcyanoximate
• Formula: C7 H4 N3 O Tl
• Calculated formula: C7 H4 N3 O Tl
• Title of publication: Synthesis, Characterization, and Studies of Coordination-Polymeres With Isomeric Pyridylcyanoximes: Route to Metal Ribbons With Very Short Tl···Tl Separations
• Authors of publication: Marcano, Daniela; Gerasimchuk, Nikolay; Nemykin, Victor; Silchenko, Svitlana
• Journal of publication: Crystal Growth & Design
• Year of publication: 2012
• Journal volume: 12
• Journal issue: 6
• Pages of publication: 2877
• a: 3.7364 ± 0.0008 Å
• b: 9.365 ± 0.002 Å
• c: 12.156 ± 0.003 Å
• α: 68.14 ± 0.002°
• β: 86.965 ± 0.003°
• γ: 79.763 ± 0.003°
• Cell volume: 388.45 ± 0.15 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0293
• Residual factor for significantly intense reflections: 0.0262
• Weighted residual factors for significantly intense reflections: 0.06
• Weighted residual factors for all reflections included in the refinement: 0.0614
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No