Geometry & MOs

Info

ID:	374986
PubChem CID:	131408690
Reduced:	NOSF3H8C10 (1)
Stoich.:	ABCD3E8F10 (1)
Weight, g/mol:	247.02787
ΔH_f, kcal/mol:	-165.3
Dipole, Da:	6.97
IP(EA), eV:	-8.49(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-2-(trifluoromethyl)-1-benzothiophen-4-amine

Drug info:

PubChemData

Smile

COC1=CC2=C(C=CC(=C2S1)C(F)(F)F)N

DOS

IR

Vibrations