(1S)-1-(1-Naphthylmethyl)-1,2,3,4-Tetrahydro-6,7-Isoquinolinediol

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Properties Simple | Detailed

Formula C20H19NO2
IUPAC Name (1s)-1-(1-naphthylmethyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol
Molecular Mass 305.370 g·mol−1
Heat of Formation -122.2 ± 16.7 kJ·mol−1
Dipole Moment 0.91 ± 1.08 D
Volume 365.26 Å 3
Surface Area 318.77 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy 2.54 ± eV
Point Group Symmetry C1
Synonyms
  • (1s)-1-(1-naphthylmethyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol
  • (1s)-1-(naphthalen-1-ylmethyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol
InChIKey YGCQFKVNIBDJFW-SFHVURJKSA-N
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