Geometry & MOs

Info

ID:	190484
PubChem CID:	78011255
Reduced:	BrO3N5C11H14 (1)
Stoich.:	AB3C5D11E14 (1)
Weight, g/mol:	369.194008
ΔH_f, kcal/mol:	-72.19
Dipole, Da:	5.31
IP(EA), eV:	-9.73(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3,9,10-tetramethoxy-6-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[3,2-a]isoquinoline

Drug info:

PubChemData

Smile

C1C(C(OC1N2C3=NC=NC(=C3N=C2Br)CN)CO)O

DOS

IR

Vibrations