Geometry & MOs

Info

ID:	337545
PubChem CID:	127258168
Reduced:	SF3N3O4H16C18 (1)
Stoich.:	AB3C3D4E16F18 (1)
Weight, g/mol:	182.061076
ΔH_f, kcal/mol:	-262.3
Dipole, Da:	5.83
IP(EA), eV:	-8.92(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methylindol-3-amine;hydrochloride

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1=CC2=C(N=CN=C2S1)OC3=CC=C(C=C3)OC(F)(F)F

DOS

IR

Vibrations