Geometry & MOs

Info

ID:	256933
PubChem CID:	103142497
Reduced:	O2C15H22 (1)
Stoich.:	A2B15C22 (1)
Weight, g/mol:	274.240899
ΔH_f, kcal/mol:	-99.38
Dipole, Da:	4.04
IP(EA), eV:	-9.3(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylpropyl)-N-pentan-3-yl-1,2,3,4-tetrahydroisoquinolin-8-amine

Drug info:

PubChemData

Smile

CC1CCC(O1)CC(CO)C2=CC=CC=C2C

DOS

IR

Vibrations