17-(Cyclopropylmethyl)Morphinan-6-One

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Formula C20H25NO
IUPAC Name (1s,9r,10r)-17-(cyclopropylmethyl)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2,4,6-trien-13-one
Molecular Mass 295.419 g·mol−1
Heat of Formation -44.4 ± 16.7 kJ·mol−1
Dipole Moment 3.60 ± 1.08 D
Volume 377.0 Å 3
Surface Area 308.03 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy 0.34 ± eV
Point Group Symmetry C1
Synonyms
  • cprmmo
  • morphinan-6-one, 17-(cyclopropylmethyl)-
  • n-cyclopropylmethylmorphinan-6-one
CAS Number(s)
  • 112246-80-7
InChIKey IKVDDEJTDBWEJX-XUVXKRRUSA-N
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