Information card for entry 4002873

Structure parameters

• Formula: C2 H12 Br4 N2 Pd
• Calculated formula: C2 H12 Br4 N2 Pd
• SMILES: C[NH3+].Br[Pd](Br)([Br-])[Br-].C[NH3+]
• Title of publication: Synthesis of Lead-Free Perovskite Films by Combinatorial Evaporation: Fast Processes for Screening Different Precursor Combinations
• Authors of publication: Wong, Man Kwong; Liu, Fangzhou; Kam, Chun Sing; Leung, Tik Lun; Tam, Ho Won; Djurišić, Aleksandra B.; Popović, Jasminka; Li, Hangkong; Shih, Kaimin; Low, Kam-Hung; Chan, Wai Kin; Chen, Wei; He, Zhubing; Ng, Annie; Surya, Charles
• Journal of publication: Chemistry of Materials
• Year of publication: 2017
• Journal volume: 29
• Journal issue: 23
• Pages of publication: 9946
• a: 9.9491 ± 0.0004 Å
• b: 10.5856 ± 0.0004 Å
• c: 10.6882 ± 0.0004 Å
• α: 90°
• β: 102.604 ± 0.002°
• γ: 90°
• Cell volume: 1098.52 ± 0.07 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0673
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.0836
• Weighted residual factors for all reflections included in the refinement: 0.0928
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No