Geometry & MOs

Info

ID:	346964
PubChem CID:	127271468
Reduced:	O2N3C19H29 (1)
Stoich.:	A2B3C19D29 (1)
Weight, g/mol:	388.247441
ΔH_f, kcal/mol:	-63.86
Dipole, Da:	2.87
IP(EA), eV:	-8.72(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-3-[[4-(2-methylpropyl)morpholin-2-yl]methyl]urea

Drug info:

PubChemData

Smile

CC(C)CN1CCOC(C1)CNC(=O)NC2(CC2)C3=CC=CC=C3

DOS

IR

Vibrations