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Information card for entry 4024647
Preview
Coordinates | 4024647.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C27 H43 N O Si2 |
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Calculated formula | C27 H43 N O Si2 |
SMILES | C[Si](C)(C)CC1=C2CCC(C)(C)[C@H]([C@@H]2n2c3ccccc3cc12)O[Si](C)(C)C(C)(C)C.C[Si](C)(C)CC1=C2CCC(C)(C)[C@@H]([C@H]2n2c3ccccc3cc12)O[Si](C)(C)C(C)(C)C |
Title of publication | Allenyl Azide Cycloaddition Chemistry. 2,3-Cyclopentennelated Indole Synthesis through Indolidene Intermediates |
Authors of publication | Feldman, Ken S.; Hester, D. Keith; Iyer, Malliga R.; Munson, Paul J.; Silva López, Carlos; Faza, Olalla Nieto |
Journal of publication | Journal of Organic Chemistry |
Year of publication | 2009 |
Journal volume | 74 |
Journal issue | 14 |
Pages of publication | 4958 - 4974 |
a | 11.869 ± 0.002 Å |
b | 10.874 ± 0.002 Å |
c | 22.01 ± 0.004 Å |
α | 90° |
β | 93.52 ± 0.03° |
γ | 90° |
Cell volume | 2835.2 ± 1 Å3 |
Cell temperature | 123 ± 2 K |
Ambient diffraction temperature | 123 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.1086 |
Residual factor for significantly intense reflections | 0.0738 |
Weighted residual factors for significantly intense reflections | 0.1783 |
Weighted residual factors for all reflections included in the refinement | 0.1939 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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