Rotational Spectrum, Conformational Composition, Intramolecular Hydrogen Bonding, and Quantum Chemical Calculations of Mercaptoacetonitrile (HSCH2C≡N), a Compound of Potential Astrochemical Interest

Harald Møllendal; Svein Samdal; Jean-Claude Guillemin

doi:10.1021/acs.jpca.6b01600

Rotational Spectrum, Conformational Composition, Intramolecular Hydrogen Bonding, and Quantum Chemical Calculations of Mercaptoacetonitrile (HSCH2C≡N), a Compound of Potential Astrochemical Interest

The Journal of Physical Chemistry A ◽

10.1021/acs.jpca.6b01600 ◽

2016 ◽

Vol 120 (12) ◽

pp. 1992-2001 ◽

Cited By ~ 5

Author(s):

Harald Møllendal ◽

Svein Samdal ◽

Jean-Claude Guillemin

Keyword(s):

Hydrogen Bonding ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Intramolecular Hydrogen Bonding ◽

Rotational Spectrum ◽

Conformational Composition ◽

Intramolecular Hydrogen

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Microwave Spectrum, Intramolecular Hydrogen Bonding, Conformational Properties and Quantum Chemical Calculations for 3,3,3-Trifluoropropanol.

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Hydrogen Bonding ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Intramolecular Hydrogen Bonding ◽

Microwave Spectrum ◽

Conformational Properties ◽

Intramolecular Hydrogen

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Hydrogen Bonding ◽

Quantum Chemical Calculations ◽

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Quantum Chemical ◽

Intramolecular Hydrogen Bonding ◽

Intramolecular Hydrogen

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Quantum Chemical Calculations ◽

Quantum Chemical ◽

Intramolecular Hydrogen Bonding ◽

Microwave Spectroscopy ◽

Intramolecular Hydrogen

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10.1021/jp953527k ◽

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Hydrogen Bonding ◽

Quantum Chemical Calculations ◽

Infrared Spectra ◽

Quantum Chemical ◽

Intramolecular Hydrogen Bonding ◽

Intramolecular Hydrogen

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Hydrogen Bonding ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Spectral Properties ◽

Intramolecular Hydrogen Bonding ◽

Intramolecular Hydrogen

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ChemInform Abstract: Intramolecular Hydrogen Bonding in 2-Hydroxybenzoyl Compounds: Infrared Spectra and Quantum Chemical Calculations

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Hydrogen Bonding ◽

Quantum Chemical Calculations ◽

Infrared Spectra ◽

Quantum Chemical ◽

Intramolecular Hydrogen Bonding ◽

Intramolecular Hydrogen

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Quantum Chemical ◽

Linear Dichroism ◽

Intramolecular Hydrogen Bonding ◽

Electronic Transitions ◽

Intramolecular Hydrogen

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Hydrogen Bonding ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Intramolecular Hydrogen Bonding ◽

Microwave Spectroscopy ◽

Intramolecular Hydrogen

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Quantum Chemical Calculations ◽

Ir Spectrum ◽

Quantum Chemical ◽

Intramolecular Hydrogen Bonding ◽

Intramolecular Hydrogen

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Intramolecular Hydrogen Bonding ◽

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