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Information card for entry 7034093
Preview
| Coordinates | 7034093.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C83.3 H117.41 Cl4 N5.5 Nb2 O6 |
|---|---|
| Calculated formula | C83.298 H117.412 Cl4 N5.5 Nb2 O6 |
| Title of publication | Tetraphenolate niobium and tantalum complexes for the ring opening polymerization of ε-caprolactone. |
| Authors of publication | Al-Khafaji, Yahya; Sun, Xinsen; Prior, Timothy J.; Elsegood, Mark R. J.; Redshaw, Carl |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2015 |
| Journal volume | 44 |
| Journal issue | 27 |
| Pages of publication | 12349 - 12356 |
| a | 12.6086 ± 0.0009 Å |
| b | 16.8197 ± 0.0012 Å |
| c | 21.7135 ± 0.0015 Å |
| α | 89.714 ± 0.002° |
| β | 86.846 ± 0.002° |
| γ | 73.006 ± 0.002° |
| Cell volume | 4396.8 ± 0.5 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0658 |
| Residual factor for significantly intense reflections | 0.0568 |
| Weighted residual factors for significantly intense reflections | 0.1595 |
| Weighted residual factors for all reflections included in the refinement | 0.1685 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176453 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7034093.cif |
| 143640 | 2015-07-11 | cif/ Updating files of 7034090, 7034091, 7034092, 7034093, 7034094, 7034095, 7034096 Original log message: Adding full bibliography for 7034090--7034096.cif. |
7034093.cif |
| 132042 | 2015-02-19 | cif/ Adding structures of 7034090, 7034091, 7034092, 7034093, 7034094, 7034095, 7034096 via cif-deposit CGI script. |
7034093.cif |
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Users of the data should acknowledge the original authors of the
structural data.