Information card for entry 4063742

Structure parameters

• Formula: C12 H9 Cl N2 Te
• Calculated formula: C12 H9 Cl N2 Te
• SMILES: [Te]1(Cl)[N](=Nc2c1cccc2)c1ccccc1
• Title of publication: Isolation and Structural Characterization of Some Aryltellurium Halides and Their Hydrolyzed Products Stabilized by an Intramolecular Te···N Interaction
• Authors of publication: Srivastava, Kriti; Shah, Poonam; Singh, Harkesh B.; Butcher, Ray J.
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 3
• Pages of publication: 534
• a: 31.3486 ± 0.001 Å
• b: 4.0959 ± 0.0001 Å
• c: 20.1937 ± 0.0007 Å
• α: 90°
• β: 116.074 ± 0.002°
• γ: 90°
• Cell volume: 2329 ± 0.13 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0356
• Residual factor for significantly intense reflections: 0.0255
• Weighted residual factors for significantly intense reflections: 0.058
• Weighted residual factors for all reflections included in the refinement: 0.0631
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No