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Information card for entry 4350791
Preview
| Coordinates | 4350791.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | (μ3-Hydroxo)-(μ2-hydroxo)-tris(μ2-4-(2-phenylethynyl)phenylboronato) -bis(μ2-oxo)-tris(η5-pentamethyl-cyclopentadienyl)-tri-tantalum acetone toluene solvate |
|---|---|
| Formula | C85.5 H92 B3 O11 Ta3 |
| Calculated formula | C107 H114 B3 O11 Ta3 |
| Title of publication | On the Interaction of Acetone with Electrophilic Metallocavitands Having Extended Cavities |
| Authors of publication | Christian N. Garon; Maxime Daigle; Isabelle Levesque; Philippe Dufour; Hassan Iden; Christian Tessier; Thierry Maris; Jean-François Morin; Frédéric-Georges Fontaine |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2012 |
| Journal volume | 51 |
| Pages of publication | 10384 - 10393 |
| a | 12.5477 ± 0.0004 Å |
| b | 31.1331 ± 0.001 Å |
| c | 19.3082 ± 0.0006 Å |
| α | 90° |
| β | 91 ± 0.002° |
| γ | 90° |
| Cell volume | 7541.6 ± 0.4 Å3 |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for significantly intense reflections | 0.0311 |
| Weighted residual factors for significantly intense reflections | 0.0311 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 260387 (current) | 2021-01-03 | cif/ Adding structures of 4350791 via cif-deposit CGI script. |
4350791.cif |
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