Geometry & MOs

Info

ID:	69863
PubChem CID:	47205608
Reduced:	ClN2O2C12H13 (1)
Stoich.:	AB2C2D12E13 (1)
Weight, g/mol:	248.152478
ΔH_f, kcal/mol:	-60.0
Dipole, Da:	5.74
IP(EA), eV:	-9.03(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,4-dimethylanilino)-2-oxoethyl]butanamide

Drug info:

PubChemData

Smile

C1CC1C(=O)NCC(=O)NC2=CC(=CC=C2)Cl

DOS

IR

Vibrations