Geometry & MOs

Info

ID:	256176
PubChem CID:	103137543
Reduced:	N2C15H18 (1)
Stoich.:	A2B15C18 (1)
Weight, g/mol:	276.162649
ΔH_f, kcal/mol:	61.28
Dipole, Da:	1.84
IP(EA), eV:	-9.1(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[isoquinolin-8-yl-(2-methylphenyl)methyl]ethanamine

Drug info:

PubChemData

Smile

CCNC(C1CC1)C2=CC=CC3=C2C=NC=C3

DOS

IR

Vibrations