(2S)-2,3-Dihydroxy-1-(4-Methyl-9H-β-Carbolin-1-Yl)-1-Propanone

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Properties Simple | Detailed

Formula C15H14N2O3
IUPAC Name (2s)-2,3-dihydroxy-1-(4-methylpyrido[3,4-b]indol-9-ium-1-yl)propan-1-one
Molecular Mass 270.283 g·mol−1
Heat of Formation -284.9 ± 16.7 kJ·mol−1
Dipole Moment 3.71 ± 1.08 D
Volume 308.3 Å 3
Surface Area 280.5 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy -1.12 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2,3-dihydroxy-1-(4-methyl-9h-$b-carbolin-1-yl)propan-1-one
  • (2s)-2,3-dihydroxy-1-(4-methyl-9h-pyrido[3,4-b]indol-1-yl)propan-1-one
  • 1-propanone, 2,3-dihydroxy-1-(4-methyl-9h-pyrido(3,4-b)indol-1-yl)-, (+)-
  • oxopropaline d
CAS Number(s)
  • 152752-59-5
InChIKey QATLRHOKLQIJNA-NSHDSACASA-N
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