Information card for entry 7715588

Structure parameters

• Chemical name: Tz2PbCl4
• Formula: C2.29 H4.57 Cl2.29 N3.43 Pb0.57
• Calculated formula: C2.28571 H4.57143 Cl2.28571 N3.42857 Pb0.571429
• Title of publication: Revisiting a (001)-oriented layered lead chloride templated by 1,2,4-triazolium: structural phase transitions, lattice dynamics and broadband photoluminescence.
• Authors of publication: Mączka, Mirosław; Sobczak, Szymon; Ptak, Maciej; Smółka, Szymon; Fedoruk, Katarzyna; Dybała, Filip; Herman, Artur P.; Paraguassu, Waldeci; Zaręba, Jan K; Kudrawiec, Robert; Sieradzki, Adam; Katrusiak, Andrzej
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 16
• Pages of publication: 6906 - 6919
• a: 7.4798 ± 0.0004 Å
• b: 21.5667 ± 0.0013 Å
• c: 8.3086 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1340.3 ± 0.13 ų
• Cell temperature: 280.01 ± 0.1 K
• Ambient diffraction temperature: 280.15 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: 0.0325
• Residual factor for significantly intense reflections: 0.0244
• Weighted residual factors for significantly intense reflections: 0.0546
• Weighted residual factors for all reflections included in the refinement: 0.0575
• Goodness-of-fit parameter for all reflections included in the refinement: 1.133
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No