Information card for entry 4129208

Structure parameters

• Common name: PA4AgInBr8
• Formula: C12 H40 Ag Br8 In N4
• Calculated formula: C12 H40 Ag Br8 In N4
• Title of publication: Chemical and Structural Diversity of Hybrid Layered Double Perovskite Halides.
• Authors of publication: Mao, Lingling; Teicher, Samuel M. L.; Stoumpos, Constantinos C.; Kennard, Rhys M.; DeCrescent, Ryan A.; Wu, Guang; Schuller, Jon A.; Chabinyc, Michael L.; Cheetham, Anthony K.; Seshadri, Ram
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• a: 24.5633 ± 0.0013 Å
• b: 7.7838 ± 0.0004 Å
• c: 8.2501 ± 0.0004 Å
• α: 90°
• β: 90.091 ± 0.002°
• γ: 90°
• Cell volume: 1577.38 ± 0.14 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 6
• 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: 0.0661
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1457
• Weighted residual factors for all reflections included in the refinement: 0.1472
• Goodness-of-fit parameter for significantly intense reflections: 4.3
• Goodness-of-fit parameter for all reflections included in the refinement: 3.75
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No