(4S)-5-Acetyl-2-Amino-6-Methyl-4-Phenyl-4H-Pyran-3-Carbonitrile

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Properties Simple | Detailed

Formula C15H14N2O2
IUPAC Name (4s)-5-acetyl-2-amino-6-methyl-4-phenyl-4h-pyran-3-carbonitrile
Molecular Mass 254.284 g·mol−1
Heat of Formation -70.5 ± 16.7 kJ·mol−1
Dipole Moment 3.84 ± 1.08 D
Volume 308.01 Å 3
Surface Area 269.36 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy -0.48 ± eV
Point Group Symmetry C1
Synonyms
  • (4s)-2-amino-5-ethanoyl-6-methyl-4-phenyl-4h-pyran-3-carbonitrile
InChIKey JAMQLJVXPNHYPI-AWEZNQCLSA-N
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