Geometry & MOs

Info

ID:	28816
PubChem CID:	829805
Reduced:	FNO3C16H16 (1)
Stoich.:	ABC3D16E16 (1)
Weight, g/mol:	287.132157
ΔH_f, kcal/mol:	-123.71
Dipole, Da:	3.41
IP(EA), eV:	-8.61(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(2,4-dimethylphenyl)-2-(2-fluorophenoxy)propanamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=CC=CC=C1OC)OC2=CC=C(C=C2)F

DOS

IR

Vibrations