Nuclear Quadrupole Resonance (NQR)—A Useful Spectroscopic Tool in Pharmacy for the Study of Polymorphism

Nuclear Quadrupole Resonance (NQR) spectroscopy has been known for 70 years. It is suitable for the study of measured (poly)crystalline chemical compounds containing quadrupole nuclei (nuclei with spin I ≥ 1) where the characteristic NQR frequencies represent the fingerprints of these compounds. In...

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Main Authors: Zvonko Trontelj, Janez Pirnat, Vojko Jazbinšek, Janko Lužnik, Stane Srčič, Zoran Lavrič, Samo Beguš, Tomaž Apih, Veselko Žagar, Janez Seliger
Format: Article
Language:English
Published: MDPI AG 2020-05-01
Series:Crystals
Subjects:
Online Access:https://www.mdpi.com/2073-4352/10/6/450
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author Zvonko Trontelj
Janez Pirnat
Vojko Jazbinšek
Janko Lužnik
Stane Srčič
Zoran Lavrič
Samo Beguš
Tomaž Apih
Veselko Žagar
Janez Seliger
author_facet Zvonko Trontelj
Janez Pirnat
Vojko Jazbinšek
Janko Lužnik
Stane Srčič
Zoran Lavrič
Samo Beguš
Tomaž Apih
Veselko Žagar
Janez Seliger
author_sort Zvonko Trontelj
collection DOAJ
description Nuclear Quadrupole Resonance (NQR) spectroscopy has been known for 70 years. It is suitable for the study of measured (poly)crystalline chemical compounds containing quadrupole nuclei (nuclei with spin I ≥ 1) where the characteristic NQR frequencies represent the fingerprints of these compounds. In several cases, <sup>14</sup>N NQR can distinguish between the polymorphic crystalline phases of active pharmaceutical ingredients (APIs). In order to further stimulate <sup>14</sup>N NQR studies, we review here several results of API polymorphism studies obtained in Ljubljana laboratories: (a) In sulfanilamide, a clear distinction between three known polymorphs (α, β, γ) was demonstrated. (b) In famotidine, the full spectra of all seven different nitrogen positions were measured; two polymorphs were distinguished. (c) In piroxicam, the <sup>14</sup>N NQR data helped in confirming the new polymorphic form V. (d) The compaction pressure in the tablet production of paracetamol, which is connected with linewidth change, can be used to distinguish between producers of paracetamol. We established that paracetamol in the tablets of six different manufacturers can be identified by <sup>14</sup>N NQR linewidth. (e) Finally, in order to get an extremely sensitive <sup>14</sup>N NQR spectrometer, the optical detection of the <sup>14</sup>N NQR signal is mentioned.
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spelling doaj.art-449ca19663464c7289afed44c32e856a2023-11-20T02:23:10ZengMDPI AGCrystals2073-43522020-05-0110645010.3390/cryst10060450Nuclear Quadrupole Resonance (NQR)—A Useful Spectroscopic Tool in Pharmacy for the Study of PolymorphismZvonko Trontelj0Janez Pirnat1Vojko Jazbinšek2Janko Lužnik3Stane Srčič4Zoran Lavrič5Samo Beguš6Tomaž Apih7Veselko Žagar8Janez Seliger9Institute of Mathematics, Physics and Mechanics, 1000 Ljubljana, SloveniaInstitute of Mathematics, Physics and Mechanics, 1000 Ljubljana, SloveniaInstitute of Mathematics, Physics and Mechanics, 1000 Ljubljana, SloveniaInstitute of Mathematics, Physics and Mechanics, 1000 Ljubljana, SloveniaFaculty of Pharmacy, University of Ljubljana, 1000 Ljubljana, SloveniaFaculty of Pharmacy, University of Ljubljana, 1000 Ljubljana, SloveniaFaculty of Electrical Engineering, University of Ljubljana, 1000 Ljubljana, SloveniaJožef Stefan Institute, 1000 Ljubljana, SloveniaJožef Stefan Institute, 1000 Ljubljana, SloveniaJožef Stefan Institute, 1000 Ljubljana, SloveniaNuclear Quadrupole Resonance (NQR) spectroscopy has been known for 70 years. It is suitable for the study of measured (poly)crystalline chemical compounds containing quadrupole nuclei (nuclei with spin I ≥ 1) where the characteristic NQR frequencies represent the fingerprints of these compounds. In several cases, <sup>14</sup>N NQR can distinguish between the polymorphic crystalline phases of active pharmaceutical ingredients (APIs). In order to further stimulate <sup>14</sup>N NQR studies, we review here several results of API polymorphism studies obtained in Ljubljana laboratories: (a) In sulfanilamide, a clear distinction between three known polymorphs (α, β, γ) was demonstrated. (b) In famotidine, the full spectra of all seven different nitrogen positions were measured; two polymorphs were distinguished. (c) In piroxicam, the <sup>14</sup>N NQR data helped in confirming the new polymorphic form V. (d) The compaction pressure in the tablet production of paracetamol, which is connected with linewidth change, can be used to distinguish between producers of paracetamol. We established that paracetamol in the tablets of six different manufacturers can be identified by <sup>14</sup>N NQR linewidth. (e) Finally, in order to get an extremely sensitive <sup>14</sup>N NQR spectrometer, the optical detection of the <sup>14</sup>N NQR signal is mentioned.https://www.mdpi.com/2073-4352/10/6/450NQRNuclear Quadrupole Resonance spectroscopy<sup>14</sup>N NQR and relaxationdrug polymorphismcrystal polymorphismX-ray powder diffraction (XRPD)
spellingShingle Zvonko Trontelj
Janez Pirnat
Vojko Jazbinšek
Janko Lužnik
Stane Srčič
Zoran Lavrič
Samo Beguš
Tomaž Apih
Veselko Žagar
Janez Seliger
Nuclear Quadrupole Resonance (NQR)—A Useful Spectroscopic Tool in Pharmacy for the Study of Polymorphism
Crystals
NQR
Nuclear Quadrupole Resonance spectroscopy
<sup>14</sup>N NQR and relaxation
drug polymorphism
crystal polymorphism
X-ray powder diffraction (XRPD)
title Nuclear Quadrupole Resonance (NQR)—A Useful Spectroscopic Tool in Pharmacy for the Study of Polymorphism
title_full Nuclear Quadrupole Resonance (NQR)—A Useful Spectroscopic Tool in Pharmacy for the Study of Polymorphism
title_fullStr Nuclear Quadrupole Resonance (NQR)—A Useful Spectroscopic Tool in Pharmacy for the Study of Polymorphism
title_full_unstemmed Nuclear Quadrupole Resonance (NQR)—A Useful Spectroscopic Tool in Pharmacy for the Study of Polymorphism
title_short Nuclear Quadrupole Resonance (NQR)—A Useful Spectroscopic Tool in Pharmacy for the Study of Polymorphism
title_sort nuclear quadrupole resonance nqr a useful spectroscopic tool in pharmacy for the study of polymorphism
topic NQR
Nuclear Quadrupole Resonance spectroscopy
<sup>14</sup>N NQR and relaxation
drug polymorphism
crystal polymorphism
X-ray powder diffraction (XRPD)
url https://www.mdpi.com/2073-4352/10/6/450
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