(6Ar)-6-Methyl-5,6,6A,7-Tetrahydro-4H-Dibenzo[De,G]Quinoline-10,11-Diyl Dibutanoate

Molecule SVG Image

Properties Simple | Detailed

Formula C25H29NO4
IUPAC Name [(6ar)-11-butanoyloxy-6-methyl-5,6,6a,7-tetrahydro-4h-dibenzo[de,g]quinolin-10-yl] butanoate
Molecular Mass 407.502 g·mol−1
Heat of Formation -619.7 ± 16.7 kJ·mol−1
Dipole Moment 2.84 ± 1.08 D
Volume 500.29 Å 3
Surface Area 405.87 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy -0.39 ± eV
Point Group Symmetry C1
Synonyms
  • butanoic acid, 5,6,6a,7-tetrahydro-6-methyl-4h-dibenzo(de,g)quinoline-10,11-diyl ester, (r)-
  • dibutyrylapomorphine
CAS Number(s)
  • 42390-72-7
InChIKey FHXAWNCBUXBJHB-LJQANCHMSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N