(11α,13Beta)-Chelidonine

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Properties Simple | Detailed

Formula C20H19NO5
IUPAC Name (11alpha,13beta)-chelidonine
Molecular Mass 353.369 g·mol−1
Heat of Formation -520.8 ± 16.7 kJ·mol−1
Dipole Moment 1.94 ± 1.08 D
Volume 386.41 Å 3
Surface Area 327.73 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy -0.01 ± eV
Point Group Symmetry C1
Synonyms
  • [1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridin-6-ol, 5b,6,7,12b,13,14-hexahydro-13-methyl-
InChIKey GHKISGDRQRSCII-NIKGAXFTSA-N
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