Information card for entry 7719360

Structure parameters

• Formula: C4 H16 Br3.5 In0.5 N2
• Calculated formula: C4 H16 Br3.5 In0.5 N2
• Title of publication: Stable zero-dimensional hybrid indium-based halides with yellow to orange light emission.
• Authors of publication: Zan, Hong-Zhao; Wang, Xiao-Zhong; Zhao, Hai-Xin; Wang, Shou-Wang; Chen, Lei; Wang, Hao-Yuan; Zhao, Lai-Zhi; Zhang, Xiao-De; Kong, Xiang-Wen
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 37
• Pages of publication: 13909 - 13917
• a: 10.677 ± 0.0009 Å
• b: 13.4631 ± 0.0013 Å
• c: 8.9606 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1288 ± 0.2 ų
• Cell temperature: 273.15 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 5
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0358
• Residual factor for significantly intense reflections: 0.0241
• Weighted residual factors for significantly intense reflections: 0.0379
• Weighted residual factors for all reflections included in the refinement: 0.0406
• Goodness-of-fit parameter for all reflections included in the refinement: 0.996
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No