Geometry & MOs

Info

ID:	207641
PubChem CID:	80431905
Reduced:	N3H15C16 (1)
Stoich.:	A3B15C16 (1)
Weight, g/mol:	292.10342
ΔH_f, kcal/mol:	77.08
Dipole, Da:	3.75
IP(EA), eV:	-8.5(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dihydro-1H-isothiochromen-4-yl)isoquinolin-8-amine

Drug info:

PubChemData

Smile

CC(C1=CC=NC=C1)NC2=CC=CC3=C2C=NC=C3

DOS

IR

Vibrations