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Information card for entry 4082920
Preview
| Coordinates | 4082920.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C17 H14 Ag F6 N3 O2 |
|---|---|
| Calculated formula | C17 H14 Ag F6 N3 O2 |
| Title of publication | Mechanistic Understanding of a Silver Pyridylpyrrolide as a Catalyst for 3 + 2 Cyclization of a Nitrile with Diazo Ester |
| Authors of publication | Flores, Jaime A.; Pal, Kuntal; Carroll, Maria E.; Pink, Maren; Karty, Jonathan A.; Mindiola, Daniel J.; Caulton, Kenneth G. |
| Journal of publication | Organometallics |
| Year of publication | 2014 |
| Journal volume | 33 |
| Journal issue | 7 |
| Pages of publication | 1544 |
| a | 10.4411 ± 0.0012 Å |
| b | 6.8784 ± 0.0008 Å |
| c | 12.5348 ± 0.0014 Å |
| α | 90° |
| β | 97.708 ± 0.002° |
| γ | 90° |
| Cell volume | 892.09 ± 0.18 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 11 |
| Hermann-Mauguin space group symbol | P 1 21/m 1 |
| Hall space group symbol | -P 2yb |
| Residual factor for all reflections | 0.0227 |
| Residual factor for significantly intense reflections | 0.0203 |
| Weighted residual factors for significantly intense reflections | 0.049 |
| Weighted residual factors for all reflections included in the refinement | 0.05 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.113 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176432 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
4082920.cif |
| 109885 | 2014-04-17 | cif/ Updating files of 4082920 Original log message: Adding full bibliography for 4082920.cif. |
4082920.cif |
| 109780 | 2014-04-17 | cif/ (saulius@koala.ibt.lt) Restoring in bulk the COD CIFs that had their bibliographies update recently: svn merge -r109779:109651 . The problem was that: a) the COD deposition pipeline incorrectly folded some text fields; b) it removed last page number from some CIFs that had it before. An attempt to updated bibliographies will be repeated with corrected scripts. |
4082920.cif |
| 109756 | 2014-04-17 | cif/ Updating files of 4082920 Original log message: Adding full bibliography for ./tmp-cod-update-bibliographies-28993/cifs/4082920.cif. |
4082920.cif |
| 108698 | 2014-04-02 | cif/ Adding structures of 4082920 via cif-deposit CGI script. |
4082920.cif |
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Users of the data should acknowledge the original authors of the
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