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Information card for entry 7018774
Preview
Coordinates | 7018774.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C38 H52 Se2 Th |
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Calculated formula | C38 H52 Se2 Th |
SMILES | [c]12([cH]3[c]4([cH]5[cH]1[Th]16782345([c]2([cH]1[c]6([cH]7[cH]82)C(C)(C)C)C(C)(C)C)([Se]c1ccccc1)[Se]c1ccccc1)C(C)(C)C)C(C)(C)C |
Title of publication | A bipyridyl thorium metallocene: synthesis, structure and reactivity |
Authors of publication | Ren, Wenshan; Song, Haibin; Zi, Guofu; Walter, Marc D. |
Journal of publication | Dalton Transactions |
Year of publication | 2012 |
Journal volume | 41 |
Journal issue | 19 |
Pages of publication | 5965 |
a | 12.0333 ± 0.0016 Å |
b | 16.165 ± 0.002 Å |
c | 19.461 ± 0.003 Å |
α | 90° |
β | 104.175 ± 0.002° |
γ | 90° |
Cell volume | 3670.3 ± 0.9 Å3 |
Cell temperature | 110 ± 2 K |
Ambient diffraction temperature | 110 ± 2 K |
Number of distinct elements | 4 |
Space group number | 7 |
Hermann-Mauguin space group symbol | P 1 c 1 |
Hall space group symbol | P -2yc |
Residual factor for all reflections | 0.0535 |
Residual factor for significantly intense reflections | 0.0428 |
Weighted residual factors for significantly intense reflections | 0.0905 |
Weighted residual factors for all reflections included in the refinement | 0.0954 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
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/7018774.html
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