Geometry & MOs

Info

ID:	188916
PubChem CID:	77785170
Reduced:	FON2C18H23 (1)
Stoich.:	ABC2D18E23 (1)
Weight, g/mol:	285.136493
ΔH_f, kcal/mol:	-60.16
Dipole, Da:	1.99
IP(EA), eV:	-8.99(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-hydroxy-6-methyl-2,3,4,4a,5,6,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one

Drug info:

PubChemData

Smile

CC(C(C(C1=CC=CC=C1)NCCC2=CC=C(C=C2)F)N)O

DOS

IR

Vibrations