[(1R)-1,8-Diethyl-1,3,4,9-Tetrahydropyrano[3,4-B]Indol-1-Yl]Acetic Acid

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Formula C17H21NO3
IUPAC Name 2-[(1r)-1,8-diethyl-3,4-dihydropyrano[3,4-b]indol-9-ium-9a-ylium-1-yl]acetic acid
Molecular Mass 287.354 g·mol−1
Heat of Formation -515.2 ± 16.7 kJ·mol−1
Dipole Moment 3.01 ± 1.08 D
Volume 355.18 Å 3
Surface Area 302.96 Å 2
HOMO Energy -8.35 ± 0.55 eV
LUMO Energy -0.09 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[(1r)-1,8-diethyl-4,9-dihydro-3h-pyrano[3,4-b]indol-1-yl]acetic acid
  • 2-[(1r)-1,8-diethyl-4,9-dihydro-3h-pyrano[3,4-b]indol-1-yl]ethanoic acid
  • ks-1056
InChIKey NNYBQONXHNTVIJ-QGZVFWFLSA-N
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