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Information card for entry 7061163
Preview
| Coordinates | 7061163.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | (S)-(2-(2-(methoxymethyl)pyrrolidin-1-yl)-2H-inden-2-yl)lithium |
|---|---|
| Formula | C15 H18 Li N O |
| Calculated formula | C15 H18 Li N O |
| Title of publication | Novel approach for the synthesis of chiral organometallic complexes – first series of lithium 2-amino-indenide ligands bearing pendant donor groups and a unique helical bent-zirconocene |
| Authors of publication | Rufanov, Konstantin A.; Titov, Ilya Yu.; Lemenovskii, Dmitry A.; Krut’ko, Dmitry P.; Churakov, Andrei V. |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2022 |
| Journal volume | 46 |
| Journal issue | 3 |
| Pages of publication | 1409 - 1415 |
| a | 7.6958 ± 0.0002 Å |
| b | 8.1833 ± 0.0002 Å |
| c | 20.4464 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1287.65 ± 0.06 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.1049 |
| Residual factor for significantly intense reflections | 0.0599 |
| Weighted residual factors for significantly intense reflections | 0.1216 |
| Weighted residual factors for all reflections included in the refinement | 0.1423 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.015 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 288183 (current) | 2023-12-08 | cod/ Corrected misspelt data names in multiple entries using the 'cif_correct_tags' program and a data names replacement file from cod-tools revision 9827. This change affected only the misspelt variants of the '_atom_site_symmetry_multiplicity' data name. |
7061163.cif |
| 272741 | 2022-02-04 | cif/ Updating files of 7061163 Original log message: Adding full bibliography for 7061163.cif. |
7061163.cif |
| 271594 | 2021-12-23 | cif/ Adding structures of 7061163 via cif-deposit CGI script. |
7061163.cif |
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