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Information card for entry 7014670
Preview
Coordinates | 7014670.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C21 H40 N13 O14 Tb |
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Calculated formula | C21 H34 N13 O14 Tb |
SMILES | C1C[N]2=Cc3[n](ccn3C)[Tb]34562([N]1(CC[N]3=Cc1[n]4ccn1C)CC[N]5=Cc1[n]6ccn1C)([OH2])[OH2].N(=O)(=O)[O-].N(=O)(=O)[O-].N(=O)(=O)[O-].O.O.O |
Title of publication | Luminescence tuning of imidazole-based lanthanide(iii) complexes [Ln = Sm, Eu, Gd, Tb, Dy]. |
Authors of publication | Kachi-Terajima, Chihiro; Yanagi, Katsuya; Kaziki, Toru; Kitazawa, Takafumi; Hasegawa, Miki |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2011 |
Journal volume | 40 |
Journal issue | 10 |
Pages of publication | 2249 - 2256 |
a | 14.4831 ± 0.0007 Å |
b | 15.3207 ± 0.0007 Å |
c | 14.9738 ± 0.0007 Å |
α | 90° |
β | 93.346 ± 0.001° |
γ | 90° |
Cell volume | 3316.9 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 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 | 0.0533 |
Residual factor for significantly intense reflections | 0.0513 |
Weighted residual factors for significantly intense reflections | 0.1019 |
Weighted residual factors for all reflections included in the refinement | 0.1027 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.343 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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