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Information card for entry 1512242
Preview
| Coordinates | 1512242.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C15 H14 O2 |
|---|---|
| Calculated formula | C15 H14 O2 |
| SMILES | O1C(Cc2c(C1=O)ccc1ccccc21)(C)C |
| Title of publication | Atom Economical, One-Pot, Three-Reaction Cascade to Novel Tricyclic 2,4-Dihydro-1H-benzo[f]isochromenes. |
| Authors of publication | Hinkle, Robert J.; Lewis, Shane E. |
| Journal of publication | Organic letters |
| Year of publication | 2013 |
| Journal volume | 15 |
| Journal issue | 16 |
| Pages of publication | 4070 - 4073 |
| a | 10.06 ± 0.0001 Å |
| b | 16.5507 ± 0.0002 Å |
| c | 7.0852 ± 0.0001 Å |
| α | 90° |
| β | 105.783 ± 0.001° |
| γ | 90° |
| Cell volume | 1135.21 ± 0.02 Å3 |
| Number of distinct elements | 3 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1512242.cif |
| 88041 | 2013-08-28 | cif/1/51/22/ (saulius@koala.ibt.lt) Manually adding the file from 10.1021/ol401600j -- it misses a lot of important crystallographic information, but this information can be found in the online supporting PDF (a link is added in the depositor comments). |
1512242.cif |
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