(3S)-N-Methyl-3-[2-(Methylsulfanyl)Phenoxy]-3-Phenyl-1-Propanamine

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Properties Simple | Detailed

Formula C17H21NOS
IUPAC Name (3s)-n-methyl-3-(2-methylsulfanylphenoxy)-3-phenyl-propan-1-amine
Molecular Mass 287.420 g·mol−1
Heat of Formation 6.2 ± 16.7 kJ·mol−1
Dipole Moment 3.91 ± 1.08 D
Volume 368.68 Å 3
Surface Area 317.64 Å 2
HOMO Energy -8.11 ± 0.55 eV
LUMO Energy -0.16 ± eV
Point Group Symmetry C1
Synonyms
  • (3s)-n-methyl-3-(2-methylsulfanylphenoxy)-3-phenyl-propan-1-amine
  • (3s)-n-methyl-3-[2-(methylthio)phenoxy]-3-phenylpropan-1-amine
  • methyl-[(3s)-3-[2-(methylthio)phenoxy]-3-phenyl-propyl]amine
InChIKey NDVZIUGCCMZHLG-HNNXBMFYSA-N
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