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Information card for entry 7247385
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Coordinates | 7247385.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C34 H22 Br N O6 |
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Calculated formula | C34 H22 Br N O6 |
Title of publication | Multicomponent reaction (MCR) for constructing bis-spirocyclohexane skeletons using β-nitrostyrene derived MBH acetates, 1,3-indanedione and aldehydes via [1 + 1 + 1 + 3] annulation |
Authors of publication | Gudise, Veera Babu; Anwar, Shaik |
Journal of publication | RSC Advances |
Year of publication | 2023 |
Journal volume | 13 |
Journal issue | 39 |
Pages of publication | 27456 - 27460 |
a | 12.187 ± 0.011 Å |
b | 12.588 ± 0.012 Å |
c | 18.681 ± 0.016 Å |
α | 90° |
β | 106.238 ± 0.014° |
γ | 90° |
Cell volume | 2752 ± 4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.09 |
Residual factor for significantly intense reflections | 0.0586 |
Weighted residual factors for significantly intense reflections | 0.1161 |
Weighted residual factors for all reflections included in the refinement | 0.1293 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
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/7247385.html
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Users of the data should acknowledge the original authors of the
structural data.