Geometry & MOs

Info

ID:	69886
PubChem CID:	47205692
Reduced:	NO2C7H9 (2)
Stoich.:	AB2C7D9 (2)
Weight, g/mol:	248.152478
ΔH_f, kcal/mol:	-147.58
Dipole, Da:	3.55
IP(EA), eV:	-8.8(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-oxo-2-(1-phenylethylamino)ethyl]butanamide

Drug info:

PubChemData

Smile

CCCC(=O)NCC(=O)NCC1=CC2=C(C=C1)OCO2

DOS

IR

Vibrations