Geometry & MOs

Info

ID:	19627
PubChem CID:	569372
Reduced:	NSO4C17H17 (1)
Stoich.:	ABC4D17E17 (1)
Weight, g/mol:	331.087829
ΔH_f, kcal/mol:	-143.55
Dipole, Da:	9.29
IP(EA), eV:	-9.02(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-acetyl-2-benzamido-4-methylthiophene-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=CC=CC=C2

DOS

IR

Vibrations