Information card for entry 4506173

Structure parameters

• Common name: Tl(4PCO)
• Chemical name: Thallium(I) 4-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: 3.899 ± 0.0004 Å
• b: 12.38 ± 0.0013 Å
• c: 16.7563 ± 0.0017 Å
• α: 90°
• β: 93.536 ± 0.002°
• γ: 90°
• Cell volume: 807.28 ± 0.14 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0822
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.1401
• Weighted residual factors for all reflections included in the refinement: 0.1533
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No