Geometry & MOs

Info

ID:	80381
PubChem CID:	49834226
Reduced:	N2O3C23H26 (1)
Stoich.:	A2B3C23D26 (1)
Weight, g/mol:	390.169191
ΔH_f, kcal/mol:	-70.63
Dipole, Da:	3.87
IP(EA), eV:	-8.5(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-pyridin-2-ylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)C2=C(C3=CC=CC=C3C(=O)N2)OCCN4CCCCC4

DOS

IR

Vibrations