Detalles de la búsqueda
1.
Molecular Structure of Pyrazinamide: A Critical Assessment of Modern Gas Electron Diffraction Data from Three Laboratories.
J Phys Chem A
; 124(25): 5204-5211, 2020 Jun 25.
Artículo
en Inglés
| MEDLINE | ID: mdl-32482073
2.
Structure of C60F36: A Gas-Phase Electron Diffraction and Quantum Chemical Computational Study of a Remarkably Distorted Fluorofullerene.
J Phys Chem A
; 124(49): 10216-10224, 2020 Dec 10.
Artículo
en Inglés
| MEDLINE | ID: mdl-33200926
3.
Experiment and theory at the convergence limit: accurate equilibrium structure of picolinic acid by gas-phase electron diffraction and coupled-cluster computations.
Phys Chem Chem Phys
; 20(15): 9787-9795, 2018 Apr 18.
Artículo
en Inglés
| MEDLINE | ID: mdl-29564453
4.
Nitroxoline Molecule: Planar or Not? A Story of Battle between π-π Conjugation and Interatomic Repulsion.
J Phys Chem A
; 122(6): 1691-1701, 2018 Feb 15.
Artículo
en Inglés
| MEDLINE | ID: mdl-29360361
5.
Molecular structure of clonidine: gas-phase electron diffraction, single-crystal X-ray diffraction and quantum chemical studies.
Phys Chem Chem Phys
; 19(6): 4618-4626, 2017 Feb 08.
Artículo
en Inglés
| MEDLINE | ID: mdl-28124696
6.
Gas phase equilibrium structure of histamine.
Phys Chem Chem Phys
; 18(8): 6092-102, 2016 Feb 17.
Artículo
en Inglés
| MEDLINE | ID: mdl-26845147
7.
From the determination of the accurate equilibrium structure of 1-methylthymine by gas electron diffraction and coupled cluster computations to the observation of methylation and flexibility effects in pyrimidine nucleobases.
J Phys Chem A
; 119(1): 152-9, 2015 Jan 08.
Artículo
en Inglés
| MEDLINE | ID: mdl-25514198
8.
Conformational and Bonding Properties of 3,3-Dimethyl- and 6,6-Dimethyl-1,5-diazabicyclo[3.1.0]hexane: A Case Study Employing the Monte Carlo Method in Gas Electron Diffraction.
J Phys Chem A
; 119(44): 10871-81, 2015 Nov 05.
Artículo
en Inglés
| MEDLINE | ID: mdl-26461037
9.
Interplay of experiment and theory: determination of an accurate equilibrium structure of 1-methyluracil by the gas electron diffraction method and coupled-cluster computations.
J Phys Chem A
; 117(44): 11374-81, 2013 Nov 07.
Artículo
en Inglés
| MEDLINE | ID: mdl-24168752
10.
Structure and bonding nature of the strained Lewis acid 3-methyl-1-boraadamantane: a case study employing a new data-analysis procedure in gas electron diffraction.
Chemistry
; 18(34): 10585-94, 2012 Aug 20.
Artículo
en Inglés
| MEDLINE | ID: mdl-22791415
11.
Molecular structure of 9H-adenine tautomer: gas-phase electron diffraction and quantum-chemical studies.
J Phys Chem A
; 113(49): 13816-23, 2009 Dec 10.
Artículo
en Inglés
| MEDLINE | ID: mdl-19863126
12.
Study of the thymine molecule: equilibrium structure from joint analysis of gas-phase electron diffraction and microwave data and assignment of vibrational spectra using results of ab initio calculations.
J Phys Chem A
; 112(33): 7662-70, 2008 Aug 21.
Artículo
en Inglés
| MEDLINE | ID: mdl-18665577
13.
Molecular structure of 1,5-diazabicyclo[3.1.0]hexane as determined by gas electron diffraction and quantum-chemical calculations.
J Phys Chem A
; 112(23): 5243-50, 2008 Jun 12.
Artículo
en Inglés
| MEDLINE | ID: mdl-18491847
14.
Molecular structure and conformational composition of 1,3-dihydroxyacetone studied by combined analysis of gas-phase electron diffraction data, rotational constants, and results of theoretical calculations. Ideal gas thermodynamic properties of 1,3-dihydroxyacetone.
J Phys Chem A
; 111(28): 6434-42, 2007 Jul 19.
Artículo
en Inglés
| MEDLINE | ID: mdl-17595068
Resultados
1 -
14
de 14
1
Próxima >
>>