Information card for entry 7062582

Structure parameters

• Formula: C28 H36 Bi2 I6 N12 S8
• Calculated formula: C28 H36 Bi2 I6 N12 S8
• Title of publication: Heteroleptic six-coordinate bismuth(iii) complexes with 2-acetylthiophene thiosemicarbazones: synthesis, characterization, and biological properties
• Authors of publication: Ozturk, Ibrahim I.; Turk, Kadriye; Grześkiewicz, Anita M.; Kubicki, Maciej; Banti, Christina N.; Hadjikakou, Sotiris K.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2023
• Journal volume: 47
• Journal issue: 27
• Pages of publication: 12779 - 12789
• a: 10.6012 ± 0.0004 Å
• b: 11.3117 ± 0.0004 Å
• c: 11.8373 ± 0.0004 Å
• α: 97.356 ± 0.003°
• β: 113.144 ± 0.003°
• γ: 100.017 ± 0.003°
• Cell volume: 1254.76 ± 0.09 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0246
• Residual factor for significantly intense reflections: 0.0222
• Weighted residual factors for significantly intense reflections: 0.0482
• Weighted residual factors for all reflections included in the refinement: 0.0493
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No