N-[(5S)-4-Acetyl-5-Methyl-5-Phenyl-4,5-Dihydro-1,3,4-Thiadiazol-2-Yl]Acetamide

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Properties Simple | Detailed

Formula C13H15N3O2S
IUPAC Name n-[(5s)-4-acetyl-5-methyl-5-phenyl-1,3,4-thiadiazol-2-yl]acetamide
Molecular Mass 277.342 g·mol−1
Heat of Formation -141.5 ± 16.7 kJ·mol−1
Dipole Moment 4.59 ± 1.08 D
Volume 323.34 Å 3
Surface Area 287.88 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy 2.07 ± eV
Point Group Symmetry C1
Synonyms
  • n-[(5s)-4-ethanoyl-5-methyl-5-phenyl-1,3,4-thiadiazol-2-yl]ethanamide
InChIKey JEFVYQYZCAVNTP-ZDUSSCGKSA-N
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