Geometry & MOs

Info

ID:	414137
PubChem CID:	135087092
Reduced:	N2F3H8C9 (1)
Stoich.:	A2B3C8D9 (1)
Weight, g/mol:	200.056133
ΔH_f, kcal/mol:	-122.38
Dipole, Da:	5.07
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.824631
Charge, e:	0

Chem-info

IUPAC name:

6-(trifluoromethyl)-3H-indol-2-amine

Drug info:

PubChemData

Smile

C1C2=C(C=C(C=C2)C(F)(F)F)[NH+]=C1N

DOS

IR

Vibrations