Geometry & MOs

Info

ID:	257018
PubChem CID:	103143099
Reduced:	ON2H16C18 (1)
Stoich.:	AB2C16D18 (1)
Weight, g/mol:	272.152478
ΔH_f, kcal/mol:	28.08
Dipole, Da:	3.36
IP(EA), eV:	-8.45(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-isoquinolin-8-yl-1-morpholin-3-ylpropan-2-ol

Drug info:

PubChemData

Smile

C1CNC2=C1C=CC=C2C(C3=CC=CC4=C3C=NC=C4)O

DOS

IR

Vibrations