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Information card for entry 7031772
Preview
| Coordinates | 7031772.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C103 H134.5 N3.5 O16 W2 |
|---|---|
| Calculated formula | C103 H132.834 N3.5 O16 W2 |
| Title of publication | Ethyleneglycol tungsten complexes of calix[6 and 8]arenes: synthesis, characterization and ROP of ε-caprolactone. |
| Authors of publication | Li, Yuanzhuo; Zhao, Ke-Qing; Feng, Chun; Elsegood, Mark R. J.; Prior, Timothy J.; Sun, Xinsen; Redshaw, Carl |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2014 |
| Journal volume | 43 |
| Journal issue | 36 |
| Pages of publication | 13612 - 13619 |
| a | 14.8901 ± 0.0011 Å |
| b | 17.5516 ± 0.0013 Å |
| c | 22.0164 ± 0.0016 Å |
| α | 112.022 ± 0.0009° |
| β | 105.391 ± 0.001° |
| γ | 93.0486 ± 0.001° |
| Cell volume | 5067.2 ± 0.6 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 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 | 0.1172 |
| Residual factor for significantly intense reflections | 0.0763 |
| Weighted residual factors for significantly intense reflections | 0.1588 |
| Weighted residual factors for all reflections included in the refinement | 0.175 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.113 |
| Diffraction radiation wavelength | 0.6884 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 288505 (current) | 2023-12-22 | Corrected misspelt data names in multiple entries using the 'cif_correct_tags' program and a data name replacement file from cod-tools revision 9880. This change affected only the misspelt variants of the '_iucr_refine_instructions_details' data name. |
7031772.cif |
| 176453 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7031772.cif |
| 123457 | 2014-09-08 | cif/ Updating files of 7031769, 7031770, 7031771, 7031772, 7031773 Original log message: Adding full bibliography for 7031769--7031773.cif. |
7031772.cif |
| 120870 | 2014-07-29 | cif/ Adding structures of 7031769, 7031770, 7031771, 7031772, 7031773 via cif-deposit CGI script. |
7031772.cif |
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Users of the data should acknowledge the original authors of the
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