Information card for entry 4301170

Structure parameters

• Common name: [TcOCl(Et2NC(S)NC(Ph)NNC(S)N(CH2)6)]
• Formula: C19 H27 Cl N5 O S2 Tc
• Calculated formula: C19 H27 Cl N5 O S2 Tc
• Title of publication: Oxotechnetium(V) Complexes with a Novel Class of Tridentate Thiosemicarbazide Ligands
• Authors of publication: Hung Huy Nguyen; Pedro I. da S. Maia; Victor M. Deflon; Ulrich Abram
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 25 - 27
• a: 9.213 ± 0.001 Å
• b: 10.906 ± 0.001 Å
• c: 11.792 ± 0.001 Å
• α: 90°
• β: 106.73 ± 0.01°
• γ: 90°
• Cell volume: 1134.7 ± 0.2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0525
• Residual factor for significantly intense reflections: 0.0463
• Weighted residual factors for significantly intense reflections: 0.13
• Weighted residual factors for all reflections included in the refinement: 0.1583
• Goodness-of-fit parameter for all reflections included in the refinement: 1.108
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No