NMR-TS: de novo molecule identification from NMR spectra
نویسندگان
چکیده
منابع مشابه
AB Initio Calculations of NMR Spectra for H20114C9N4 As A New Nanosemiconductor Molecule
BCN compounds have been researched theoretically and experimentally widely. In this paper, weintroduce the theoretical prediction of ternary B-C-N compounds. NMR spectroscopy was employedextensively to study these ternary nanostructures. We discuss the utilization of chemical shiftinformation as well as ab initio calculations of nuclear shielding for H20134C9N4 structuredetermination. We calcul...
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bcn compounds have been researched theoretically and experimentally widely. in this paper, weintroduce the theoretical prediction of ternary b-c-n compounds. nmr spectroscopy was employedextensively to study these ternary nanostructures. we discuss the utilization of chemical shiftinformation as well as ab initio calculations of nuclear shielding for h20134c9n4 structuredetermination. we calcul...
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ژورنال
عنوان ژورنال: Science and Technology of Advanced Materials
سال: 2020
ISSN: 1468-6996,1878-5514
DOI: 10.1080/14686996.2020.1793382