Geometry & MOs

Info

ID:	205152
PubChem CID:	80060756
Reduced:	O2S2N3H13C14 (1)
Stoich.:	A2B2C3D13E14 (1)
Weight, g/mol:	291.083019
ΔH_f, kcal/mol:	-13.97
Dipole, Da:	2.48
IP(EA), eV:	-8.43(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1H-indol-2-ylsulfanyl)isoquinolin-8-amine

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=C(N2)SC3=CC(=C(C=C3)S(=O)(=O)N)N

DOS

IR

Vibrations