Information card for entry 7719482

Structure parameters

• Formula: C I6 N2 O4 Pb8
• Calculated formula: C I6 N2 O4 Pb8
• Title of publication: A mixed-anion compound based upon a [Pb₄O₄] heterocubane unit: synthesis, structure and electronic properties of Pb₈O₄I₆(CN₂).
• Authors of publication: Schwarz, Albert T.; Petersen, Nele; Ströbele, Markus; Enseling, David; Jüstel, Thomas; Slabon, Adam; Meyer, H-Jürgen
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 40
• Pages of publication: 15169 - 15175
• a: 18.805 ± 0.0005 Å
• b: 8.1308 ± 0.0001 Å
• c: 16.1378 ± 0.0004 Å
• α: 90°
• β: 114.053 ± 0.003°
• γ: 90°
• Cell volume: 2253.21 ± 0.1 ų
• Cell temperature: 150 ± 0.11 K
• Ambient diffraction temperature: 150 ± 0.11 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0113
• Residual factor for significantly intense reflections: 0.0108
• Weighted residual factors for significantly intense reflections: 0.0214
• Weighted residual factors for all reflections included in the refinement: 0.0215
• Goodness-of-fit parameter for all reflections included in the refinement: 1.222
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No