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Information card for entry 4070315
Preview
| Coordinates | 4070315.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H36 B N8 O3 P W |
|---|---|
| Calculated formula | C24 H34 B N8 O3 P W |
| Title of publication | Michael−Aldol Ring Closures with Dihapto-Coordinated Pyrrole Complexes and the Synthesis of Tetrahydroindole Cores |
| Authors of publication | Welch, Kevin D.; Harrison, Daniel P.; Sabat, Michal; Hejazi, Emily Z.; Parr, Brendan T.; Fanelli, Matthew G.; Gianfrancesco, Nicole A.; Nagra, Dalsher S.; Myers, William H.; Harman, W. Dean |
| Journal of publication | Organometallics |
| Year of publication | 2009 |
| Journal volume | 28 |
| Journal issue | 20 |
| Pages of publication | 5960 |
| a | 11.06 ± 0.002 Å |
| b | 11.61 ± 0.002 Å |
| c | 22.088 ± 0.004 Å |
| α | 90° |
| β | 90.92 ± 0.03° |
| γ | 90° |
| Cell volume | 2835.9 ± 0.9 Å3 |
| Cell temperature | 153 ± 2 K |
| Ambient diffraction temperature | 153 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0332 |
| Residual factor for significantly intense reflections | 0.0256 |
| Weighted residual factors for significantly intense reflections | 0.0622 |
| Weighted residual factors for all reflections included in the refinement | 0.0641 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178592 (current) | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/03. |
4070315.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4070315.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4070315.cif |
| 40686 | 2012-03-08 | ../uploads/cif-deposit/cod/cif Adding structures of 4070315 via cif-deposit CGI script. |
4070315.cif |
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Users of the data should acknowledge the original authors of the
structural data.