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Information card for entry 7156646
Preview
Coordinates | 7156646.cif |
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Original paper (by DOI) | HTML |
Formula | C39 H40 Cl2 N4 O5 |
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Calculated formula | C39 H40 Cl2 N4 O5 |
Title of publication | Pseudo five component reaction towards densely functionalized spiro[indole-3,2'-pyrrole] by picric acid, an efficient syn-diastereoselective catalyst: insight into the diastereoselection on C(sp<sup>3</sup>)-C(sp<sup>3</sup>) axial conformation. |
Authors of publication | Sengupta, Ayon; Maity, Suvendu; Mondal, Animesh; Ghosh, Prasanta; Rudra, Sonali; Mukhopadhyay, Chhanda |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2019 |
Journal volume | 17 |
Journal issue | 5 |
Pages of publication | 1254 - 1265 |
a | 10.6167 ± 0.0004 Å |
b | 12.0022 ± 0.0004 Å |
c | 14.9533 ± 0.0006 Å |
α | 101.198 ± 0.002° |
β | 95.592 ± 0.002° |
γ | 103.53 ± 0.002° |
Cell volume | 1796.75 ± 0.12 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 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 | 0.0997 |
Residual factor for significantly intense reflections | 0.0767 |
Weighted residual factors for significantly intense reflections | 0.2247 |
Weighted residual factors for all reflections included in the refinement | 0.2492 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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