Geometry & MOs

Info

ID:	257133
PubChem CID:	103143985
Reduced:	FN2H15C17 (1)
Stoich.:	AB2C15D17 (1)
Weight, g/mol:	276.162649
ΔH_f, kcal/mol:	28.22
Dipole, Da:	0.66
IP(EA), eV:	-9.09(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-isoquinolin-8-ylphenyl)methyl]propan-2-amine

Drug info:

PubChemData

Smile

CNCC1=C(C=C(C=C1)C2=CC=CC3=C2C=NC=C3)F

DOS

IR

Vibrations