Geometry & MOs

Info

ID:	154886
PubChem CID:	56314431
Reduced:	FOSN3C21H24 (1)
Stoich.:	ABCD3E21F24 (1)
Weight, g/mol:	389.126106
ΔH_f, kcal/mol:	-33.48
Dipole, Da:	5.87
IP(EA), eV:	-8.68(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-N-[2-(2-fluorophenyl)-2-methylpropyl]-3-(methoxymethyl)-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)CN1C2=CC=CC=C2N=C1CSC)C3=CC=CC=C3F

DOS

IR

Vibrations