Geometry & MOs

Info

ID:	371621
PubChem CID:	131269105
Reduced:	NSF4H5C9 (1)
Stoich.:	ABC4D5E9 (1)
Weight, g/mol:	235.007883
ΔH_f, kcal/mol:	-169.53
Dipole, Da:	5.03
IP(EA), eV:	-8.8(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-fluoro-5-(trifluoromethyl)-1-benzothiophen-7-amine

Drug info:

PubChemData

Smile

C1=CSC2=C(C(=C(C=C21)F)C(F)(F)F)N

DOS

IR

Vibrations