App to predict 13C NMR spectrum: draw a structure to see its spectrum. The accuracy of the algorithm is about 2.0 ppm (RMSD=3.5 ppm).
Main features:
- Draw chemical structure.
- Instantly re-calculate spectrum while changing structure.
- Exchange data with mobile devices via iCloud.
- Print report.
- Zoom in spectrum.
- Option to display chemical shift values on structure.
Battery Report creates detailed reports about your computer and any connected power sources.
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