Geometry & MOs

Info

ID:	303719
PubChem CID:	124490096
Reduced:	N2O4C13H24 (1)
Stoich.:	A2B4C13D24 (1)
Weight, g/mol:	281.141579
ΔH_f, kcal/mol:	-188.15
Dipole, Da:	0.21
IP(EA), eV:	-8.88(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3aS,4R,9bS)-9b-methyl-3,3a,4,5-tetrahydro-2H-furo[3,2-c]quinolin-4-yl]phenol

Drug info:

PubChemData

Smile

C[C@@H]1CN(CCN1CCC(=O)OC)CCC(=O)OC

DOS

IR

Vibrations