ROP of R-manOCA: DFT study
ROP of R-manOCA: DFT study
Protocol:ωB97XD/6-31++G(d,p)/SCRF=(cpcm,solvent=chloroform)
Gaussian09 rev A.02 output file
Cite this dataset as:
Buchard, A.,
2013.
ROP of R-manOCA: DFT study.
figshare.
Available from: https://doi.org/10.6084/m9.figshare.786543.
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Creators
Antoine Buchard
University of Bath
Contributors
Matthew Davidson
Project Leader
University of Bath
Dave Carbery
Project Leader
University of Bath
University of Bath
Rights Holder
Coverage
Temporal coverage:
From 3 April 2013 to 14 October 2014
Documentation
Data collection method:
DFT Protocol: rωb97xD/6-31++g(d,p)/ SCRF=(cpcm,solvent= chloroform) Software: Gaussian09 rev A.02
Funders
Engineering and Physical Sciences Research Council (EPSRC)
https://doi.org/10.13039/501100000266
Modular Helicenoid Lewis Base Catalysts Applied to Modern Synthesis and Materials
EP/J005118/1
University of Bath
https://doi.org/10.13039/501100000835
Whorrod Research Fellowship
Publication details
Publication date: 3 September 2013
by: figshare
Version: 1
DOI: https://doi.org/10.6084/m9.figshare.786543
URL for this record: https://researchdata.bath.ac.uk/id/eprint/107
Related papers and books
Buchard, A., Carbery, D. R., Davidson, M. G., Ivanova, P. K., Jeffery, B. J., Kociok-Köhn, G. I., and Lowe, J. P., 2014. Preparation of Stereoregular Isotactic Poly(mandelic acid) through Organocatalytic Ring-Opening Polymerization of a Cyclic<i>O</i>-Carboxyanhydride. Angewandte Chemie International Edition, 53(50), 13858-13861. Available from: https://doi.org/10.1002/anie.201407525.
Contact information
Please contact the Research Data Service in the first instance for all matters concerning this item.
Contact person: Antoine Buchard
Faculty of Science
Chemistry
