Information card for entry 4003670

Structure parameters

• Formula: C7 H19 I3 N4 O2 Pb
• Calculated formula: C7 H19 I3 N4 O2 Pb
• Title of publication: Formamidinium Haloplumbate Intermediates: The Missing Link in a Chain of Hybrid Perovskites Crystallization
• Authors of publication: Petrov, Andrey A.; Fateev, Sergey A.; Khrustalev, Victor N.; Li, Yumao; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Goodilin, Eugene A.; Tarasov, Alexey B.
• Journal of publication: Chemistry of Materials
• Year of publication: 2020
• a: 7.8788 ± 0.0016 Å
• b: 10.497 ± 0.002 Å
• c: 12.678 ± 0.003 Å
• α: 75.92 ± 0.03°
• β: 75.11 ± 0.03°
• γ: 68.82 ± 0.03°
• Cell volume: 931.6 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0592
• Residual factor for significantly intense reflections: 0.0537
• Weighted residual factors for significantly intense reflections: 0.1263
• Weighted residual factors for all reflections included in the refinement: 0.1303
• Goodness-of-fit parameter for all reflections included in the refinement: 0.951
• Diffraction radiation wavelength: 0.80246 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No