Geometry & MOs

Info

ID:	255962
PubChem CID:	103135934
Reduced:	N2C17H22 (1)
Stoich.:	A2B17C22 (1)
Weight, g/mol:	230.141913
ΔH_f, kcal/mol:	46.81
Dipole, Da:	1.79
IP(EA), eV:	-9.07(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-isoquinolin-8-yl-2-propan-2-yloxyethanamine

Drug info:

PubChemData

Smile

CCCNC(C1CC1C)C2=CC=CC3=C2C=NC=C3

DOS

IR

Vibrations