DELTA50: A Highly Accurate Database of Experimental 1H and 13C NMR Chemical Shifts Applied to DFT Benchmarking.
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| Title: | DELTA50: A Highly Accurate Database of Experimental 1H and 13C NMR Chemical Shifts Applied to DFT Benchmarking. |
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| Authors: | Cohen RD; Analytical Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA.; Department of Chemistry and Biochemistry, Seton Hall University, South Orange, NJ 07079, USA., Wood JS; Analytical Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA.; Department of Chemistry and Biochemistry, University of North Carolina Wilmington, Wilmington, NC 28409, USA., Lam YH; Department of Computational and Structural Chemistry, Merck & Co., Inc., Rahway, NJ 07065, USA., Buevich AV; Analytical Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Sherer EC; Analytical Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Reibarkh M; Analytical Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Williamson RT; Department of Chemistry and Biochemistry, University of North Carolina Wilmington, Wilmington, NC 28409, USA., Martin GE; Department of Chemistry and Biochemistry, Seton Hall University, South Orange, NJ 07079, USA. |
| Source: | Molecules (Basel, Switzerland) [Molecules] 2023 Mar 07; Vol. 28 (6). Date of Electronic Publication: 2023 Mar 07. |
| Publication Type: | Journal Article |
| Journal Info: | Publisher: MDPI Country of Publication: Switzerland NLM ID: 100964009 Publication Model: Electronic Cited Medium: Internet ISSN: 1420-3049 (Electronic) Linking ISSN: 14203049 NLM ISO Abbreviation: Molecules Subsets: MEDLINE; PubMed not MEDLINE |
| Database: | MEDLINE Ultimate |
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| ISSN: | 1420-3049 |
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| DOI: | 10.3390/molecules28062449 |
