Geometry & MOs

Info

ID:	256220
PubChem CID:	103137833
Reduced:	ON4C15H20 (1)
Stoich.:	AB4C15D20 (1)
Weight, g/mol:	266.121927
ΔH_f, kcal/mol:	-6.94
Dipole, Da:	5.3
IP(EA), eV:	-8.45(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-fluoro-4-methylphenyl)-isoquinolin-8-ylmethanamine

Drug info:

PubChemData

Smile

CCCCN(CC(=O)N)C1=C2C=NC=CC2=C(C=C1)N

DOS

IR

Vibrations