Geometry & MOs

Info

ID:	35758
PubChem CID:	7980290
Reduced:	FNO4H16C17 (1)
Stoich.:	ABC4D16E17 (1)
Weight, g/mol:	400.998841
ΔH_f, kcal/mol:	-159.33
Dipole, Da:	2.89
IP(EA), eV:	-9.08(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-oxo-1-(2,4,6-trichloroanilino)propan-2-yl] 2-phenoxyacetate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=CC=CC=C1F)OC(=O)COC2=CC=CC=C2

DOS

IR

Vibrations