Geometry & MOs

Info

ID:	311069
PubChem CID:	126589073
Reduced:	NO2F3C21H24 (1)
Stoich.:	AB2C3D21E24 (1)
Weight, g/mol:	345.149557
ΔH_f, kcal/mol:	-225.5
Dipole, Da:	5.02
IP(EA), eV:	-8.59(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(2-chloro-4-ethyl-5-methylphenoxy)methyl]-3-methylphenyl]-N-methylacetamide

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=C(C=CC=C2C(F)(F)F)CC(=O)NC)CC

DOS

IR

Vibrations