Information card for entry 4343085

Structure parameters

• Common name: [ReOL10]
• Formula: C23 H25 N4 O5 Re S
• Calculated formula: C23 H25 N4 O5 Re S
• Title of publication: Rhenium and Technetium Complexes with Pentadentate Thiocarbamoylbenzamidines: Steps toward Bioconjugation.
• Authors of publication: Nguyen, Hung Huy; Pham, Chien Thang; Abram, Ulrich
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 12
• Pages of publication: 5949 - 5959
• a: 32.448 ± 0.003 Å
• b: 7.1599 ± 0.001 Å
• c: 20.521 ± 0.002 Å
• α: 90°
• β: 100.688 ± 0.01°
• γ: 90°
• Cell volume: 4684.8 ± 0.9 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• 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: 0.125
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for significantly intense reflections: 0.0776
• Weighted residual factors for all reflections included in the refinement: 0.0946
• Goodness-of-fit parameter for all reflections included in the refinement: 0.872
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No