Geometry & MOs

Info

ID:	311067
PubChem CID:	126589069
Reduced:	ClNO3C21H26 (1)
Stoich.:	ABC3D21E26 (1)
Weight, g/mol:	339.147058
ΔH_f, kcal/mol:	-117.38
Dipole, Da:	6.4
IP(EA), eV:	-8.73(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(4-ethyl-2-methylphenoxy)methyl]-3-formylphenyl]-N-methyl-2-oxoacetamide

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1C)OCC2=C(C=CC=C2OCC)CC(=O)NC)Cl

DOS

IR

Vibrations