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Information card for entry 4107410
Preview
Coordinates | 4107410.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C22 H26 Cl7 D2 N O4 |
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Calculated formula | C22 H28 Cl7 N O4 |
Title of publication | Evolution of a Synthetic Strategy: Total Synthesis of (\±)-Welwitindolinone A Isonitrile |
Authors of publication | Sarah E. Reisman; Joseph M. Ready; Matthew M. Weiss; Atsushi Hasuoka; Makoto Hirata; Kazuhiko Tamaki; Timo V. Ovaska; Catherine J. Smith; John L. Wood |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2008 |
Journal volume | 130 |
Pages of publication | 2087 - 2100 |
a | 10.625 ± 0.002 Å |
b | 11.705 ± 0.002 Å |
c | 12.203 ± 0.002 Å |
α | 80.13 ± 0.03° |
β | 68.04 ± 0.03° |
γ | 84.11 ± 0.03° |
Cell volume | 1385.5 ± 0.5 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0712 |
Residual factor for significantly intense reflections | 0.0467 |
Weighted residual factors for significantly intense reflections | 0.1356 |
Weighted residual factors for all reflections included in the refinement | 0.1517 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.002 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4107410.html
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Users of the data should acknowledge the original authors of the
structural data.