Geometry & MOs

Info

ID:	194510
PubChem CID:	78546624
Reduced:	SO3N4C20H20 (1)
Stoich.:	AB3C4D20E20 (1)
Weight, g/mol:	345.137636
ΔH_f, kcal/mol:	21.66
Dipole, Da:	9.49
IP(EA), eV:	-9.68(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-fluoroanilino)-1-oxopropan-2-yl] 2-(2,4-dimethylphenoxy)acetate

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)COC(=O)C(=CC1=CC=CS1)N2C(=NN=N2)C3=CC=CC=C3

DOS

IR

Vibrations