Conformational sampling and large amplitude motion of methyl valerate
نویسندگان
چکیده
Θ-Problem: the interplay of microwave spectroscopy and quantum chemistry to explore soft degree freedom around a carbonyl bond methyl internal rotation.
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ژورنال
عنوان ژورنال: Physical Chemistry Chemical Physics
سال: 2021
ISSN: ['1463-9076', '1463-9084']
DOI: https://doi.org/10.1039/d0cp06057g