Geometry & MOs

Info

ID:	32576
PubChem CID:	7846019
Reduced:	ClNO3H20C25 (1)
Stoich.:	ABC3D20E25 (1)
Weight, g/mol:	365.083014
ΔH_f, kcal/mol:	-36.82
Dipole, Da:	2.43
IP(EA), eV:	-9.02(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(2-fluoroanilino)-1-oxopropan-2-yl] 2-(4-chloro-3-methylphenoxy)acetate

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)OCCOC4=CC=CC=C4Cl

DOS

IR

Vibrations