Geometry & MOs

Info

ID:	55611
PubChem CID:	17395662
Reduced:	O2N3C21H27 (1)
Stoich.:	A2B3C21D27 (1)
Weight, g/mol:	365.210327
ΔH_f, kcal/mol:	-44.45
Dipole, Da:	3.28
IP(EA), eV:	-8.3(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-morpholin-4-ylphenyl)propanamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NC(=O)C(C)N2CCN(CC2)C3=CC(=CC=C3)OC

DOS

IR

Vibrations