Information card for entry 4517797

Structure parameters

• Formula: C28.5 H58.5 Ba Br6 N1.5 O13.5 Rb Sb
• Calculated formula: C28.5 H58.5 Ba Br6 N1.5 O13.5 Rb Sb
• Title of publication: Supramolecular Approach for Fine-Tuning of the Bright Luminescence from Zero-Dimensional Antimony(III) Halides
• Authors of publication: Morad, Viktoriia; Yakunin, Sergii; Kovalenko, Maksym V.
• Journal of publication: ACS Materials Letters
• Year of publication: 2020
• Pages of publication: 845 - 852
• a: 14.0505 ± 0.0005 Å
• b: 14.0505 ± 0.0005 Å
• c: 21.0782 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3603.7 ± 0.2 ų
• Cell temperature: 138 ± 3 K
• Ambient diffraction temperature: 138 ± 3 K
• Number of distinct elements: 8
• Space group number: 146
• Hermann-Mauguin space group symbol: R 3 :H
• Hall space group symbol: R 3
• Residual factor for all reflections: 0.0324
• Residual factor for significantly intense reflections: 0.0257
• Weighted residual factors for significantly intense reflections: 0.0596
• Weighted residual factors for all reflections included in the refinement: 0.0618
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No