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Information card for entry 7039717
Preview
Coordinates | 7039717.cif |
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Original paper (by DOI) | HTML |
Formula | C30 H43 Ho N2 O |
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Calculated formula | C30 H43 Ho N2 O |
SMILES | [Ho]12345678([N](C8CCCCC8)=C(C#CC%10CC%10)N8C8CCCCC8)([CH]8=[CH]1[CH]2=[CH]3[CH]4=[CH]5[CH]6=[CH]78)[O]1CCCC1 |
Title of publication | Five different types of η(8)-cyclooctatetraenyl-lanthanide half-sandwich complexes from one ligand set, including a "giant neodymium wheel". |
Authors of publication | Sroor, Farid M.; Hrib, Cristian G.; Liebing, Phil; Hilfert, Liane; Busse, Sabine; Edelmann, Frank T. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 34 |
Pages of publication | 13332 - 13346 |
a | 12.872 ± 0.003 Å |
b | 14.491 ± 0.003 Å |
c | 15.056 ± 0.003 Å |
α | 90° |
β | 100.37 ± 0.03° |
γ | 90° |
Cell volume | 2762.5 ± 1.1 Å3 |
Cell temperature | 133 ± 2 K |
Ambient diffraction temperature | 133 ± 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 | 0.0461 |
Residual factor for significantly intense reflections | 0.0362 |
Weighted residual factors for significantly intense reflections | 0.0843 |
Weighted residual factors for all reflections included in the refinement | 0.0881 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7039717.html
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