Geometry & MOs

Info

ID:	154489
PubChem CID:	56313940
Reduced:	NO4C23H31 (1)
Stoich.:	AB4C23D31 (1)
Weight, g/mol:	371.135528
ΔH_f, kcal/mol:	-143.1
Dipole, Da:	4.74
IP(EA), eV:	-8.83(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-3-(methoxymethyl)-N-(3-phenylbutyl)-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NCCC(C)C2=CC=CC=C2

DOS

IR

Vibrations