A Reliable and Efficient First Principles-Based Method for Predicting pKa Values. 2. Organic Acids-Reference-Cited by-同舟云学术

A Reliable and Efficient First Principles-Based Method for Predicting pKa Values. 2. Organic Acids

Published:2009-12-04 Issue:1 Volume:114 Page:432-442
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Zhang Shuming¹,Baker Jon¹,Pulay Peter¹

Affiliation:

1. Department of Chemistry and Biochemistry, University of Arkansas, Fayetteville, Arkansas 72701, and Parallel Quantum Solutions, 2013 Green Acres Road, Suite A, Fayetteville, Arkansas 72703

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp9067087

Reference53 articles.

1. Potentiometric and spectrophotometric pKa determination of water-insoluble compounds: Validation study in a new cosolvent system

2. Detection of amino acid and peptide phosphate protonation using Raman spectroscopy

3. Ionization conditions for iontophoretic drug delivery. A revised pKa of lidocaine hydrochloride in aqueous solution at 25°C established by precision conductometry

4. Guidelines for NMR measurements for determination of high and low pKa values (IUPAC Technical Report)

5. Positive electrospray liquid chromatography/mass spectrometry using high-pH gradients: a way to combine selectivity and sensitivity for a large variety of drugs

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