Geometry & MOs

Info

ID:	603
PubChem CID:	3063
Reduced:	NO3C18H23 (1)
Stoich.:	AB3C18D23 (1)
Weight, g/mol:	301.167794
ΔH_f, kcal/mol:	-96.21
Dipole, Da:	2.91
IP(EA), eV:	-8.24(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1CCC23C4C1CC5=C2C(=C(C=C5)OC)OC3C(CC4)O

DOS

IR

Vibrations