Information card for entry 7707999

Structure parameters

• Formula: C44 H47 N4 O12.5 Tb2
• Calculated formula: C44 H46 N4 O12.5 Tb2
• Title of publication: Intense multi-colored luminescence in a series of rare-earth metal-organic frameworks with aliphatic linkers.
• Authors of publication: Demakov, Pavel A.; Ryadun, Alexey A.; Dorovatovskii, Pavel V.; Lazarenko, Vladimir A.; Samsonenko, Denis G.; Brylev, Konstantin A.; Fedin, Vladimir P.; Dybtsev, Danil N.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 34
• Pages of publication: 11899 - 11908
• a: 10.4023 ± 0.0005 Å
• b: 17.5671 ± 0.0008 Å
• c: 12.2985 ± 0.0008 Å
• α: 90°
• β: 103.709 ± 0.006°
• γ: 90°
• Cell volume: 2183.4 ± 0.2 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0315
• Residual factor for significantly intense reflections: 0.0222
• Weighted residual factors for significantly intense reflections: 0.0433
• Weighted residual factors for all reflections included in the refinement: 0.0451
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No