Pterocellin D

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Properties Simple | Detailed

Formula C19H22N2O3
IUPAC Name 1-isobutyl-6-isopropyl-8-methoxy-4,9-dihydro-3h-pyrido[4,3-b]indolizine-1,2,3,4,4a,5a,6,8,9,10a-decaide-5,7-dione
Molecular Mass 326.390 g·mol−1
Heat of Formation -257.6 ± 16.7 kJ·mol−1
Dipole Moment 2.27 ± 1.08 D
Volume 394.16 Å 3
Surface Area 345.77 Å 2
HOMO Energy -8.34 ± 0.55 eV
LUMO Energy 1.25 ± eV
Point Group Symmetry C1
Synonyms
  • 1-isobutyl-6-isopropyl-8-methoxy-pyrido[4,3-b]indolizine-5,7-dione
  • 1-isobutyl-6-isopropyl-8-methoxy-pyrido[4,3-b]indolizine-5,7-quinone
  • 1-isobutyl-6-isopropyl-8-methoxypyrido[4,3-b]indolizine-5,7-dione
  • 8-methoxy-1-(2-methylpropyl)-6-propan-2-yl-pyrido[4,3-b]indolizine-5,7-dione
  • 8-methoxy-1-(2-methylpropyl)-6-propan-2-ylpyrido[4,3-b]indolizine-5,7-dione
InChIKey YQHVSSSUUIVBQC-UHFFFAOYSA-N
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