Geometry & MOs

Info

ID:	157147
PubChem CID:	56422191
Reduced:	FSN3O3C24H32 (1)
Stoich.:	ABC3D3E24F32 (1)
Weight, g/mol:	416.137005
ΔH_f, kcal/mol:	-153.17
Dipole, Da:	9.7
IP(EA), eV:	-9.06(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)-3-(methoxymethyl)-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CCC(=O)NC2=C(C=CC(=C2)F)N3CCCCC3

DOS

IR

Vibrations