Geometry & MOs

Info

ID:	223465
PubChem CID:	85335082
Reduced:	SN2O3C20H28 (1)
Stoich.:	AB2C3D20E28 (1)
Weight, g/mol:	376.168434
ΔH_f, kcal/mol:	-107.99
Dipole, Da:	5.33
IP(EA), eV:	-8.67(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-3-butyl-10-methoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-9-ol;dihydrochloride

Drug info:

PubChemData

Smile

CC1CCCC(N1CC(CNS(=O)(=O)C2=CC=CC3=CC=CC=C32)O)C

DOS

IR

Vibrations