Information card for entry 7711385

Structure parameters

• Formula: C16 H34 Eu N5 O16 Sr
• Calculated formula: C16 H34 Eu N5 O16 Sr
• Title of publication: Invisible strings. The first single crystal of the cTSAP form of [Eu(DOTA)(H2O)]− has an electronic structure similar to one of the reported cSAP forms
• Authors of publication: Storm Thomsen, Maria; Parsons, Simon; Sørensen, Thomas Just
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 8.9141 ± 0.0014 Å
• b: 9.2988 ± 0.0015 Å
• c: 15.741 ± 0.003 Å
• α: 85.531 ± 0.006°
• β: 82.58 ± 0.006°
• γ: 83.711 ± 0.006°
• Cell volume: 1283.4 ± 0.4 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0422
• Residual factor for significantly intense reflections: 0.0364
• Weighted residual factors for significantly intense reflections: 0.0763
• Weighted residual factors for all reflections included in the refinement: 0.0783
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No