Geometry & MOs

Info

ID:	429507
PubChem CID:	135169556
Reduced:	SN4C8H10 (1)
Stoich.:	AB4C8D10 (1)
Weight, g/mol:	218.178299
ΔH_f, kcal/mol:	64.35
Dipole, Da:	3.15
IP(EA), eV:	-8.5(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylbutan-2-yl)-1,2,3,4-tetrahydroisoquinolin-6-amine

Drug info:

PubChemData

Smile

CC(C)NC1=NSC2=NC=CN=C12

DOS

IR

Vibrations