Information card for entry 7720154

Structure parameters

• Formula: C10 H18 Br6 N4 Tc
• Calculated formula: C10 H18 Br6 N4 Tc
• Title of publication: Crystallographic insights into (ImHR)₂[TcBr₆] (Im = imidazole, R = H, Me, Et): non-covalent interactions and mass spectrometry.
• Authors of publication: Novikov, Anton P.; Volkov, Mikhail A.; Grigoriev, Mikhail S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• Journal volume: 55
• Journal issue: 9
• Pages of publication: 3990 - 3999
• a: 7.9083 ± 0.0019 Å
• b: 13.088 ± 0.004 Å
• c: 10.176 ± 0.002 Å
• α: 90°
• β: 107.329 ± 0.008°
• γ: 90°
• Cell volume: 1005.4 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0726
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0577
• Weighted residual factors for all reflections included in the refinement: 0.0668
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No