Geometry & MOs

Info

ID:	9045
PubChem CID:	85565
Reduced:	ClNO4C12H14 (1)
Stoich.:	ABC4D12E14 (1)
Weight, g/mol:	271.061136
ΔH_f, kcal/mol:	-154.71
Dipole, Da:	5.02
IP(EA), eV:	-8.29(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloro-2,4-dimethoxyphenyl)-3-oxobutanamide

Drug info:

PubChemData

Smile

CC(=O)CC(=O)NC1=CC(=C(C=C1OC)OC)Cl

DOS

IR

Vibrations