Geometry & MOs

Info

ID:	294133
PubChem CID:	117427479
Reduced:	ClNO3C13H16 (1)
Stoich.:	ABC3D13E16 (1)
Weight, g/mol:	269.081871
ΔH_f, kcal/mol:	-105.39
Dipole, Da:	5.39
IP(EA), eV:	-9.33(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-chloro-6-methoxy-2-(4-oxobutan-2-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

CC1(COC2=C(C(=CC(=C2)C(=O)CN)Cl)OC1)C

DOS

IR

Vibrations