Information card for entry 7135193

Structure parameters

• Formula: C29.03 H42.41 B N2 S
• Calculated formula: C29.026 H42.394 B N2 S
• Title of publication: Thienyl flanked bis(aminoborane)s as inorganic-organic hybrid AIEgens.
• Authors of publication: Chorbacher, Johannes; Hellinger, Anna; Klopf, Jonas; Friedrich, Alexandra; Helten, Holger
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 88
• Pages of publication: 17149 - 17152
• a: 23.7578 ± 0.0001 Å
• b: 23.7578 ± 0.0001 Å
• c: 10.4931 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5922.65 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 114
• Hermann-Mauguin space group symbol: P -4 21 c
• Hall space group symbol: P -4 2n
• Residual factor for all reflections: 0.0379
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for significantly intense reflections: 0.0979
• Weighted residual factors for all reflections included in the refinement: 0.0991
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Diffraction radiation X-ray symbol: K-L~2,3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No