Molecular determinants for drug–receptor interactions. Part 13. X-Ray molecular structure of naltrexone malonate and quantum chemical studies of the conformations of the pure narcotic antagonists naloxone and naltrexone

1990 ◽  
pp. 1757-1762 ◽  
Author(s):  
Maria E. Amato ◽  
Giuliano Bandoli ◽  
Antonio Grassi ◽  
Marino Nicolini ◽  
Giuseppe C. Pappalardo
Keyword(s):  
Molecular Structure ◽  
Quantum Chemical ◽  
X Ray ◽  
Narcotic Antagonists ◽  
Molecular Determinants ◽  
Receptor Interactions ◽  
Chemical Studies ◽  
Quantum Chemical Studies ◽  
Drug Receptor

Molecular structure of clonidine: gas-phase electron diffraction, single-crystal X-ray diffraction and quantum chemical studies

2017 ◽  
Vol 19 (6) ◽  
pp. 4618-4626 ◽  
Author(s):  
Inna N. Kolesnikova ◽  
Anatolii N. Rykov ◽  
Igor F. Shishkov ◽  
Victor A. Tafeenko ◽  
Leonid A. Aslanov
Keyword(s):  
Molecular Structure ◽  
Electron Diffraction ◽  
Gas Phase ◽  
Quantum Chemical ◽  
X Ray Diffraction ◽  
X Ray ◽  
Chemical Studies ◽  
Quantum Chemical Studies ◽  
Gas Phase Electron Diffraction

This study presents the first determination of the molecular structure of clonidine using gas electron diffraction, X-ray diffraction and quantum chemical calculations.

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