Geometry & MOs

Info

ID:	429738
PubChem CID:	135169789
Reduced:	OF6N6H14C20 (1)
Stoich.:	AB6C6D14E20 (1)
Weight, g/mol:	160.100048
ΔH_f, kcal/mol:	-244.46
Dipole, Da:	11.05
IP(EA), eV:	-8.95(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-1,2-dihydroisoquinolin-8-amine

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN=C2N)N=C(/C(=C\N)/C(=O)NC3=CC(=NC=C3)C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations