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Information card for entry 7054636
Preview
| Coordinates | 7054636.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | Ethyl(2R,3aR,10bR)-1-benzyl-10-chloro-1,2,3,3a,4,10b-hexadydropyrrolo- [2'3':3,4]pyrrolo[1,2-a]indole-2-carboxylate |
|---|---|
| Formula | C23 H23 Cl N2 O2 |
| Calculated formula | C23 H23 Cl N2 O2 |
| Title of publication | Efficient synthesis of some new antiproliferative N-fused indoles and isoquinolines via 1,3-dipolar cycloaddition reaction in an ionic liquid |
| Authors of publication | Sutariya, Tushar R.; Labana, Balvantsingh M.; Parmar, Narsidas J.; Kant, Rajni; Gupta, Vivek K.; Plata, Gabriela B.; Padrón, José M. |
| Journal of publication | New J. Chem. |
| Year of publication | 2015 |
| Journal volume | 39 |
| Journal issue | 4 |
| Pages of publication | 2657 |
| a | 9.2721 ± 0.0007 Å |
| b | 10.3272 ± 0.0006 Å |
| c | 10.7817 ± 0.0007 Å |
| α | 81.614 ± 0.005° |
| β | 81.335 ± 0.006° |
| γ | 89.456 ± 0.005° |
| Cell volume | 1009.62 ± 0.12 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.1201 |
| Residual factor for significantly intense reflections | 0.0569 |
| Weighted residual factors for significantly intense reflections | 0.1227 |
| Weighted residual factors for all reflections included in the refinement | 0.1606 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.996 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180100 (current) | 2016-03-26 | cif/7/05/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/05/46. |
7054636.cif |
| 135061 | 2015-04-06 | cif/ Updating files of 7054636, 7054637 Original log message: Adding full bibliography for 7054636--7054637.cif. |
7054636.cif |
| 130091 | 2015-01-24 | cif/ Adding structures of 7054636, 7054637 via cif-deposit CGI script. |
7054636.cif |
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