Geometry & MOs

Info

ID:	391308
PubChem CID:	135004236
Reduced:	ClNOH20C22 (1)
Stoich.:	ABCD20E22 (1)
Weight, g/mol:	276.147393
ΔH_f, kcal/mol:	17.29
Dipole, Da:	5.29
IP(EA), eV:	-8.46(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-benzyl-3-(butanoylamino)-2-oxobutanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(=O)CC(C2=CC=CC=C2)NC3=CC=C(C=C3)Cl

DOS

IR

Vibrations