About Orange NMR
App to predict 13C and 1H NMR spectra: draw a structure to see its spectrum. The accuracy of the algorithm is about 1.9 ppm for 13C and 0.21 ppm for 1H (RMSD=3.4 and 0.31 ppm correspondingly). The number of heavy atoms in...
App to predict 13C and 1H NMR spectra: draw a structure to see its spectrum. The accuracy of the algorithm is about 1.9 ppm for 13C and 0.21 ppm for 1H (RMSD=3.4 and 0.31 ppm correspondingly).
The number of heavy atoms in structure to predict for free is restricted to 12 atoms. This restriction can be removed by purchasing additional licenses.
- Instantly re-calculate spectrum while changing structure;
- Predicted spectra stored in iCloud and synchronised among all iOS devices and Mac version (itunes.apple.com/app/orange-nmr/id680184249);
- Email PDF report;
- Zoom in spectrum;
- Zoom in structure (important for iPhone users);
- Option to display chemical shift values on structure;
- Simple clean interface.
The prediction algorithm is derived by:
K. A. Blinov, E. D. Smurnyy, T. S. Churanova, M. E. Elyashberg, A. J. Williams, Chemom. Intell. Lab. Syst. 2009, 97, 91
Aug 9, 2016
Version 2.4
This app has been updated by Apple to display the Apple Watch app icon.
More accurate 3J H-H couplings prediction.
Previous Versions
Here you can find the changelog of Orange NMR since it was posted on our website on 2016-09-29 06:07:19.
The latest version is 2.4 and it was updated on 2024-04-19 22:56:16. See below the changes in each version.
Orange NMR version 2.4
Updated At: 2016-08-09
Changes: Aug 9, 2016
Version 2.4
This app has been updated by Apple to display the Apple Watch app icon.
More accurate 3J H-H couplings prediction.
Orange NMR version 2.4
Updated At: 2013-07-28
Disclaimer
Official App Store Link
We do not host Orange NMR on our servers. We did not scan it for viruses, adware, spyware or other type of malware. This app is hosted by Apple and passed their terms and conditions to be listed there. We recommend caution when installing it.
The App Store link for Orange NMR is provided to you by apps112.com without any warranties, representations or guarantees of any kind, so access it at your own risk.
If you have questions regarding this particular app contact the publisher directly. For questions about the functionalities of apps112.com contact us.
