Geometry & MOs

Info

ID:	129872
PubChem CID:	51074107
Reduced:	NOC6H7 (3)
Stoich.:	ABC6D7 (3)
Weight, g/mol:	327.158292
ΔH_f, kcal/mol:	-69.73
Dipole, Da:	3.18
IP(EA), eV:	-8.71(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,7-dimethoxy-N-(pyridin-3-ylmethyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CC1COC2=CC=CC=C2O1)C(=O)NCC3=CC=CC=N3

DOS

IR

Vibrations