Information card for entry 4002984

Structure parameters

• Formula: C H6 Br4 Cs N3 Sn
• Calculated formula: C H6 Br4 Cs N3 Sn
• Title of publication: Guanidinium and Mixed Cesium-Guanidinium Tin(II) Bromides: Effects of Quantum Confinement and Out-of-Plane Octahedral Tilting.
• Authors of publication: Nazarenko, Olga; Kotyrba, Martin R.; Yakunin, Sergii; Wörle, Michael; Benin, Bogdan M.; Rainò, Gabriele; Krumeich, Frank; Kepenekian, Mikaël; Even, Jacky; Katan, Claudine; Kovalenko, Maksym V.
• Journal of publication: Chemistry of materials : a publication of the American Chemical Society
• Year of publication: 2019
• Journal volume: 31
• Journal issue: 6
• Pages of publication: 2121 - 2129
• a: 6.0112 ± 0.001 Å
• b: 11.5363 ± 0.0018 Å
• c: 17.342 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1202.6 ± 0.3 ų
• Cell temperature: 250 K
• Ambient diffraction temperature: 250 K
• Number of distinct elements: 6
• Space group number: 74
• Hermann-Mauguin space group symbol: I m m a
• Hall space group symbol: -I 2b 2
• Residual factor for all reflections: 0.0279
• Residual factor for significantly intense reflections: 0.0227
• Weighted residual factors for significantly intense reflections: 0.0512
• Weighted residual factors for all reflections included in the refinement: 0.053
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No