Prediction of the pK(a) of carboxylic acids using the ab initio continuum-solvation model PCM-UAHF

G Schuurmann, Maurizio COSSI, V Barone, J. Tomasi

Risultato della ricerca: Contributo su rivista › Articolo in rivista

Lingua originale	Inglese
pagine (da-a)	6706-6712
Numero di pagine	7
Rivista	JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY
Volume	102
Numero di pubblicazione	33
DOI	https://doi.org/10.1021/jp981922f
Stato di pubblicazione	Pubblicato - 1998

Accesso al documento

@article{ff417df7d9124278a450c48e973c8de5,

title = "Prediction of the pK(a) of carboxylic acids using the ab initio continuum-solvation model PCM-UAHF",

author = "G Schuurmann and Maurizio COSSI and V Barone and J. Tomasi",

year = "1998",

doi = "10.1021/jp981922f",

language = "English",

volume = "102",

pages = "6706--6712",

journal = "JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, \& GENERAL THEORY",

issn = "1089-5639",

number = "33",

}

TY - JOUR

T1 - Prediction of the pK(a) of carboxylic acids using the ab initio continuum-solvation model PCM-UAHF

AU - Schuurmann, G

AU - COSSI, Maurizio

AU - Barone, V

AU - Tomasi, J.

PY - 1998

Y1 - 1998

UR - https://iris.uniupo.it/handle/11579/6123

U2 - 10.1021/jp981922f

DO - 10.1021/jp981922f

M3 - Article

SN - 1089-5639

VL - 102

SP - 6706

EP - 6712

JO - JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY

JF - JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY

IS - 33

ER -