Geometry & MOs

Info

ID:	62196
PubChem CID:	26717974
Reduced:	SN3O4C21H23 (1)
Stoich.:	AB3C4D21E23 (1)
Weight, g/mol:	375.051147
ΔH_f, kcal/mol:	-70.7
Dipole, Da:	5.85
IP(EA), eV:	-9.22(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCCCNS(=O)(=O)C1=CC=CC(=C1)NC(=O)/C=C/C2=CC=C(C=C2)OCC#N

DOS

IR

Vibrations