Information card for entry 7716958

Structure parameters

• Formula: C28 H24 F2 N4 Ni S4
• Calculated formula: C28 H24 F2 N4 Ni S4
• Title of publication: Dithiocarbamate-based novel anti-histaminic agents: synthesis, characterization, crystal structure and thermal study.
• Authors of publication: Singh, Anupam; Kumar, Rajesh; Patel, Riya; Trishna, ?; Gautam, Ram Nayan; Bharty, M. K.; Prasad, Lal Bahadur
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 33
• Pages of publication: 14077 - 14088
• a: 6.6417 ± 0.0002 Å
• b: 8.0504 ± 0.0003 Å
• c: 26.8952 ± 0.001 Å
• α: 90°
• β: 96.149 ± 0.003°
• γ: 90°
• Cell volume: 1429.77 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0696
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for significantly intense reflections: 0.1151
• Weighted residual factors for all reflections included in the refinement: 0.1267
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No