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Information card for entry 1550746
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Coordinates | 1550746.cif |
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Original paper (by DOI) | HTML |
Formula | C82 H120 O Si6 |
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Calculated formula | C82 H120 O Si6 |
Title of publication | Site-Selective Functionalization of Si6R6 Siliconoids |
Authors of publication | Heider, Yannic; Poitiers, Nadine Elisabeth; Willmes, Philipp; Leszczynska, Kinga; Huch, Volker; Scheschkewitz, David |
Journal of publication | Chemical Science |
Year of publication | 2019 |
a | 18.8229 ± 0.0006 Å |
b | 28.6659 ± 0.001 Å |
c | 30.799 ± 0.0012 Å |
α | 90° |
β | 107.786 ± 0.002° |
γ | 90° |
Cell volume | 15824.1 ± 1 Å3 |
Cell temperature | 132 ± 2 K |
Ambient diffraction temperature | 132 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.1038 |
Residual factor for significantly intense reflections | 0.0648 |
Weighted residual factors for significantly intense reflections | 0.1395 |
Weighted residual factors for all reflections included in the refinement | 0.1598 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.081 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
214124 (current) | 2019-03-15 | cif/ Adding structures of 1550741, 1550742, 1550743, 1550744, 1550745, 1550746 via cif-deposit CGI script. |
1550746.cif |
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Users of the data should acknowledge the original authors of the
structural data.