Geometry & MOs

Info

ID:	4054
PubChem CID:	10653
Reduced:	NO4C21H25 (1)
Stoich.:	AB4C21D25 (1)
Weight, g/mol:	355.178358
ΔH_f, kcal/mol:	-105.53
Dipole, Da:	2.23
IP(EA), eV:	-8.1(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3,10,11-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline

Drug info:

PubChemData

Smile

COC1=C(C=C2C3CC4=CC(=C(C=C4CN3CCC2=C1)OC)OC)OC

DOS

IR

Vibrations