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Information card for entry 4129297
Preview
| Coordinates | 4129297.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H76 N4 O12 Si4 |
|---|---|
| Calculated formula | C36 H76 N4 O12 Si4 |
| SMILES | C[Si@]1(O[Si@](O[Si@@](C)(CCCNC(=O)OC(C)(C)C)O[Si@@](O1)(C)CCCNC(=O)OC(C)(C)C)(C)CCCNC(=O)OC(C)(C)C)CCCNC(=O)OC(C)(C)C |
| Title of publication | Selective Synthesis of cis-trans-cis Cyclic Tetrasiloxanes and the Formation of Their Two-Dimensional Layered Aggregates. |
| Authors of publication | Kinoshita, Shota; Watase, Seiji; Matsukawa, Kimihiro; Kaneko, Yoshiro |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2015 |
| Journal volume | 137 |
| Journal issue | 15 |
| Pages of publication | 5061 - 5065 |
| a | 17.262 ± 0.0004 Å |
| b | 14.7551 ± 0.0004 Å |
| c | 10.0083 ± 0.0002 Å |
| α | 90° |
| β | 92.0691 ± 0.0007° |
| γ | 90° |
| Cell volume | 2547.48 ± 0.1 Å3 |
| Cell temperature | 173 K |
| Ambient diffraction temperature | 173 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for significantly intense reflections | 0.0834 |
| Weighted residual factors for all reflections included in the refinement | 0.2491 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.346 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 240046 (current) | 2019-11-25 | cif/ Adding structures of 4129297 via cif-deposit CGI script. |
4129297.cif |
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Users of the data should acknowledge the original authors of the
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