Geometry & MOs

Info

ID:	396033
PubChem CID:	135027233
Reduced:	FNO4H12C17 (1)
Stoich.:	ABC4D12E17 (1)
Weight, g/mol:	398.098808
ΔH_f, kcal/mol:	-149.53
Dipole, Da:	7.04
IP(EA), eV:	-9.84(-1.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-fluoro-2-[2-methoxy-6-[(S)-(4-methylphenyl)sulfinyl]phenyl]phenyl] acetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@@H]([C@@H](C(=O)O)N2C(=O)C3=CC=CC=C3C2=O)F

DOS

IR

Vibrations