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Cocrystals of Isoniazid with Polyphenols: Mechanochemical Synthesis and Molecular Structure
by
González-González, Juan Saulo
, Martínez-Martínez, Francisco Javier
, Flores-Alamo, Marcos
, Emparán-Legaspi, María José
, García-Ortega, Héctor
, Pineda-Contreras, Armando
, Martínez-Santiago, Ana María Monserrat
in
Analysis
/ Catechol
/ Chemical properties
/ Chemical synthesis
/ cocrystal
/ Composition
/ Crystal structure
/ Crystals
/ Data collection
/ Diffraction
/ Functional groups
/ hydrogen bond
/ Hydrogen bonding
/ Hydrogen bonds
/ Hydroxyl groups
/ Infrared spectroscopy
/ Isoniazid
/ Mechanical properties
/ mechanochemistry
/ Molecular structure
/ Pharmaceuticals
/ Phloroglucinol
/ Polyphenols
/ Single crystals
/ Software
/ Spectrum analysis
/ Structure
/ Tuberculosis
/ X ray powder diffraction
/ X-rays
2020
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Cocrystals of Isoniazid with Polyphenols: Mechanochemical Synthesis and Molecular Structure
by
González-González, Juan Saulo
, Martínez-Martínez, Francisco Javier
, Flores-Alamo, Marcos
, Emparán-Legaspi, María José
, García-Ortega, Héctor
, Pineda-Contreras, Armando
, Martínez-Santiago, Ana María Monserrat
in
Analysis
/ Catechol
/ Chemical properties
/ Chemical synthesis
/ cocrystal
/ Composition
/ Crystal structure
/ Crystals
/ Data collection
/ Diffraction
/ Functional groups
/ hydrogen bond
/ Hydrogen bonding
/ Hydrogen bonds
/ Hydroxyl groups
/ Infrared spectroscopy
/ Isoniazid
/ Mechanical properties
/ mechanochemistry
/ Molecular structure
/ Pharmaceuticals
/ Phloroglucinol
/ Polyphenols
/ Single crystals
/ Software
/ Spectrum analysis
/ Structure
/ Tuberculosis
/ X ray powder diffraction
/ X-rays
2020
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Cocrystals of Isoniazid with Polyphenols: Mechanochemical Synthesis and Molecular Structure
by
González-González, Juan Saulo
, Martínez-Martínez, Francisco Javier
, Flores-Alamo, Marcos
, Emparán-Legaspi, María José
, García-Ortega, Héctor
, Pineda-Contreras, Armando
, Martínez-Santiago, Ana María Monserrat
in
Analysis
/ Catechol
/ Chemical properties
/ Chemical synthesis
/ cocrystal
/ Composition
/ Crystal structure
/ Crystals
/ Data collection
/ Diffraction
/ Functional groups
/ hydrogen bond
/ Hydrogen bonding
/ Hydrogen bonds
/ Hydroxyl groups
/ Infrared spectroscopy
/ Isoniazid
/ Mechanical properties
/ mechanochemistry
/ Molecular structure
/ Pharmaceuticals
/ Phloroglucinol
/ Polyphenols
/ Single crystals
/ Software
/ Spectrum analysis
/ Structure
/ Tuberculosis
/ X ray powder diffraction
/ X-rays
2020
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Cocrystals of Isoniazid with Polyphenols: Mechanochemical Synthesis and Molecular Structure
Journal Article
Cocrystals of Isoniazid with Polyphenols: Mechanochemical Synthesis and Molecular Structure
2020
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Overview
Isoniazid is used as anti-tuberculosis drug which possesses functional groups capable of forming hydrogen bonds. A series of cocrystals of isoniazid (INH) with polyphenolic coformers such as catechol (CAT), orcinol (ORC), 2-methylresorcinol (MER), pyrogallol (PYR), and phloroglucinol (PLG) were prepared by solvent-assisted grinding. Powder cocrystals were characterized by infrared (IR) spectroscopy and X-ray powder diffraction. The crystal structure of the cocrystals revealed the unexpected hydration of the INH-MER cocrystal and the preference of the (phenol) O–H∙∙∙N (pyridine) and (terminal) N-H∙∙∙O (phenol) heterosynthons in the stabilization of the structures. The supramolecular architecture of the cocrystals is affected by the conformation and the substitution pattern of the hydroxyl groups of the polyphenols.
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