Information card for entry 7025395

Structure parameters

• Formula: C27 H33 N6 O14 Tb
• Calculated formula: C27 H33 N6 O14 Tb
• SMILES: [Tb]123456(OC(=O)c7[n]6c(C(=O)O2)ccc7)([n]2c(C(=O)O1)cccc2C(=O)O4)[n]1c(C(=O)O5)cccc1C(=O)O3.[NH2+](C)C.[NH2+](C)C.[NH2+](C)C.O.O
• Title of publication: Efficient, stable, tunable, and easy to synthesize, handle and recycle luminescent materials: [H2NMe2]3[Ln(III)(2,6-dipicolinolate)3] (Ln = Eu, Tb, or its solid solutions).
• Authors of publication: Mooibroek, Tiddo Jonathan; Gamez, Patrick; Pevec, Andrej; Kasunic, Marta; Kozlevcar, Bojan; Fu, Wen-Tian; Reedijk, Jan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 28
• Pages of publication: 6483 - 6487
• a: 10.6792 ± 0.0001 Å
• b: 17.0739 ± 0.0003 Å
• c: 18.7096 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3411.43 ± 0.09 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P c 21 n
• Hall space group symbol: P -2n -2ac
• Residual factor for all reflections: 0.045
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for all reflections: 0.041
• Weighted residual factors for all reflections included in the refinement: 0.024
• Goodness-of-fit parameter for all reflections: 1.752
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.71072 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No