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Information card for entry 1518528
Preview
| Coordinates | 1518528.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C30 H40 N2 O4 Si4 |
|---|---|
| Calculated formula | C30 H40 N2 O4 Si4 |
| SMILES | COC(=O)C(=C\c1ccc(cc1)[Si](C)(C)[Si](C)(C)[Si](C)(C)[Si](C)(C)c1ccc(cc1)/C=C(C#N)/C(=O)OC)\C#N |
| Title of publication | Increased carrier mobility in end-functionalized oligosilanes |
| Authors of publication | Surampudi, S.; Yeh, M.-L.; Siegler, M. A.; Hardigree, J. F. Martinez; Kasl, T. A.; Katz, H. E.; Klausen, R. S. |
| Journal of publication | Chem. Sci. |
| Year of publication | 2015 |
| Journal volume | 6 |
| Journal issue | 3 |
| Pages of publication | 1905 |
| a | 8.5558 ± 0.0005 Å |
| b | 11.887 ± 0.0004 Å |
| c | 17.0071 ± 0.0008 Å |
| α | 99.115 ± 0.003° |
| β | 92.129 ± 0.004° |
| γ | 94.397 ± 0.004° |
| Cell volume | 1700.67 ± 0.14 Å3 |
| Cell temperature | 110 ± 2 K |
| Ambient diffraction temperature | 110 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0889 |
| Residual factor for significantly intense reflections | 0.0629 |
| Weighted residual factors for significantly intense reflections | 0.1706 |
| Weighted residual factors for all reflections included in the refinement | 0.1941 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301776 (current) | 2025-08-18 | Add cross-references to PubChem compounds in COD range 1/51 Each referenced PubChem compound corresponds to the full crystal structure. |
1518528.cif |
| 176729 | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1518528.cif |
| 133119 | 2015-03-06 | cif/ Updating files of 1518526, 1518527, 1518528, 1518529 Original log message: Adding full bibliography for 1518526--1518529.cif. |
1518528.cif |
| 129380 | 2015-01-06 | cif/ Adding structures of 1518526, 1518527, 1518528, 1518529 via cif-deposit CGI script. |
1518528.cif |
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Users of the data should acknowledge the original authors of the
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