Geometry & MOs

Info

ID:	310991
PubChem CID:	126588713
Reduced:	NF2O3C21H25 (1)
Stoich.:	AB2C3D21E25 (1)
Weight, g/mol:	347.169685
ΔH_f, kcal/mol:	-223.57
Dipole, Da:	2.98
IP(EA), eV:	-8.63(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(difluoromethyl)-2-[(4-ethyl-2-methylphenoxy)methyl]phenyl]propanamide

Drug info:

PubChemData

Smile

CCC1=C(C=C(C(=C1)C)OCC2=C(C=CC=C2NC(=O)OCC)C(F)F)C

DOS

IR

Vibrations