Information card for entry 8000073

Structure parameters

• Formula: C32 H40 Cl2 N6 O11 Tc
• Calculated formula: C32 H40 Cl2 N6 O11 Tc
• Title of publication: A Novel Seven-coordinate Technetium(IV) Complex: Synthesis and Characterization of [TcO(tpen)]2+ (tpen \δb N,N,N',N'-Tetrakis(2-pyridylmethyl)ethylenediamine)
• Authors of publication: Takashi Yoshimura; Masanori Kawai; Tsutomu Takayama; Tsutomu Sekine; Hiroshi Kudo; Atsushi Shinohara
• Journal of publication: Chemistry Letters
• Year of publication: 2005
• Journal volume: 34
• Journal issue: 12
• Pages of publication: 1624
• a: 12.546 ± 0.001 Å
• b: 25.351 ± 0.004 Å
• c: 11.584 ± 0.002 Å
• α: 89°
• β: 90°
• γ: 89°
• Cell volume: 3684.3 ± 0.9 ų
• Cell temperature: 296.2 K
• Number of distinct elements: 6
• Space group number: 41
• Hermann-Mauguin space group symbol: A b a 2
• Hall space group symbol: A 2 -2ab
• Residual factor for significantly intense reflections: 0.0427
• Weighted residual factors for all reflections included in the refinement: 0.1377
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No