Geometry & MOs

Info

ID:	43990
PubChem CID:	10322761
Reduced:	NOC16H16 (2)
Stoich.:	ABC16D16 (2)
Weight, g/mol:	476.18667
ΔH_f, kcal/mol:	-20.4
Dipole, Da:	8.23
IP(EA), eV:	-8.35(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-[2-(3,4,5-trimethoxyphenyl)ethyl]phenyl]-2,3-dihydroimidazo[2,1-a]isoquinoline;hydrochloride

Drug info:

PubChemData

Smile

CC1(CCC(C2=C1C=C3CCC4=C(C3=C2)N(C=C4C5=CC=C(C=C5)C(=O)O)C6=CN=CC=C6)(C)C)C

DOS

IR

Vibrations