N-[(7R)-10-Hydroxy-1,2,3-Trimethoxy-9-Oxo-5,6,7,9-Tetrahydrobenzo[A]Heptalen-7-Yl]Acetamide

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Properties Simple | Detailed

Formula C21H23NO6
IUPAC Name n-[(7r)-10-hydroxy-1,2,3-trimethoxy-9-oxo-6,7-dihydro-5h-benzo[a]heptalen-7-yl]acetamide
Molecular Mass 385.410 g·mol−1
Heat of Formation -751.0 ± 16.7 kJ·mol−1
Dipole Moment 5.64 ± 1.08 D
Volume 452.55 Å 3
Surface Area 356.25 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy -0.70 ± eV
Point Group Symmetry C1
Synonyms
  • n-[(7r)-10-hydroxy-1,2,3-trimethoxy-9-oxo-6,7-dihydro-5h-benzo[d]heptalen-7-yl]acetamide
  • n-[(7r)-10-hydroxy-1,2,3-trimethoxy-9-oxo-6,7-dihydro-5h-benzo[d]heptalen-7-yl]ethanamide
  • n-[(7r)-10-hydroxy-9-keto-1,2,3-trimethoxy-6,7-dihydro-5h-benzo[d]heptalen-7-yl]acetamide
  • oprea1_070934
InChIKey PRGILOMAMBLWNG-OAHLLOKOSA-N
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