Information card for entry 7041762

Structure parameters

• Formula: C7 H11 I3 N2 Pb
• Calculated formula: C7 H11 I3 N2 Pb
• Title of publication: An inorganic-organic hybrid crystal with a two-step dielectric response and thermochromic luminescence.
• Authors of publication: Duan, Hai-Bao; Yu, Shan-Shan; Liu, Shao-Xian; Zhang, Hui
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 7
• Pages of publication: 2220 - 2227
• a: 7.8158 ± 0.0008 Å
• b: 10.3604 ± 0.001 Å
• c: 18.175 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1471.7 ± 0.3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0391
• Residual factor for significantly intense reflections: 0.0333
• Weighted residual factors for significantly intense reflections: 0.0868
• Weighted residual factors for all reflections included in the refinement: 0.0902
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No