Geometry & MOs

Info

ID:	374985
PubChem CID:	131408689
Reduced:	NOSF3H8C10 (1)
Stoich.:	ABCD3E8F10 (1)
Weight, g/mol:	247.02787
ΔH_f, kcal/mol:	-164.34
Dipole, Da:	6.18
IP(EA), eV:	-8.28(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-7-(trifluoromethyl)-1-benzothiophen-4-amine

Drug info:

PubChemData

Smile

COC1=CSC2=CC(=CC(=C21)N)C(F)(F)F

DOS

IR

Vibrations