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Information card for entry 4070313
Preview
| Coordinates | 4070313.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C29 H44 N4 Si |
|---|---|
| Calculated formula | C29 H44 N4 Si |
| SMILES | [SiH]1(NN)N(c2c(cccc2C(C)C)C(C)C)C(=CC(=C)N1c1c(cccc1C(C)C)C(C)C)C |
| Title of publication | Insertion Reaction of a Silylene into a N−H Bond of Hydrazine and a [1+4] Cycloaddition with Diphenyl Hydrazone§ |
| Authors of publication | Jana, Anukul; Roesky, Herbert W.; Schulzke, Carola; Samuel, Prinson P. |
| Journal of publication | Organometallics |
| Year of publication | 2009 |
| Journal volume | 28 |
| Journal issue | 22 |
| Pages of publication | 6574 |
| a | 11.574 ± 0.002 Å |
| b | 20.188 ± 0.004 Å |
| c | 12.598 ± 0.003 Å |
| α | 90° |
| β | 97.53 ± 0.03° |
| γ | 90° |
| Cell volume | 2918.2 ± 1.1 Å3 |
| Cell temperature | 133 ± 2 K |
| Ambient diffraction temperature | 133 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.1036 |
| Residual factor for significantly intense reflections | 0.0614 |
| Weighted residual factors for significantly intense reflections | 0.1333 |
| Weighted residual factors for all reflections included in the refinement | 0.1479 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301830 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/07/ Each referenced PubChem compound corresponds to the full crystal structure. |
4070313.cif |
| 178592 | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/03. |
4070313.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4070313.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4070313.cif |
| 40685 | 2012-03-08 | ../uploads/cif-deposit/cod/cif Adding structures of 4070313, 4070314 via cif-deposit CGI script. |
4070313.cif |
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Users of the data should acknowledge the original authors of the
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