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Information card for entry 7234986
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Coordinates | 7234986.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C76 H58 N2 O6 |
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Calculated formula | C76 H58 N2 O6 |
Title of publication | Establishment of atropisomerism in 3-indolyl furanoids: a synthetic, experimental and theoretical perspective |
Authors of publication | Chatterjee, Sourav; Bhattacharjee, Pinaki; Butterfoss, Glenn L.; Achari, Anushree; Jaisankar, Parasuraman |
Journal of publication | RSC Advances |
Year of publication | 2019 |
Journal volume | 9 |
Journal issue | 39 |
Pages of publication | 22384 |
a | 11.7682 ± 0.0009 Å |
b | 13.1204 ± 0.0011 Å |
c | 19.9515 ± 0.0016 Å |
α | 77.621 ± 0.004° |
β | 77.484 ± 0.003° |
γ | 85.254 ± 0.004° |
Cell volume | 2935.3 ± 0.4 Å3 |
Cell temperature | 298 K |
Ambient diffraction temperature | 296.15 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1022 |
Residual factor for significantly intense reflections | 0.059 |
Weighted residual factors for significantly intense reflections | 0.1401 |
Weighted residual factors for all reflections included in the refinement | 0.1612 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7234986.html
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Users of the data should acknowledge the original authors of the
structural data.