Geometry & MOs

Info

ID:	35838
PubChem CID:	7980389
Reduced:	FNSO3H16C17 (1)
Stoich.:	ABCD3E16F17 (1)
Weight, g/mol:	317.108565
ΔH_f, kcal/mol:	-126.52
Dipole, Da:	1.72
IP(EA), eV:	-9.2(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2-(4-thiophen-2-ylbutanoylamino)acetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC(=O)CNC(=O)CSC2=CC=C(C=C2)F

DOS

IR

Vibrations