Geometry & MOs

Info

ID:	61910
PubChem CID:	26715653
Reduced:	S2N3O5C20H25 (1)
Stoich.:	A2B3C5D20E25 (1)
Weight, g/mol:	465.089162
ΔH_f, kcal/mol:	-166.99
Dipole, Da:	6.0
IP(EA), eV:	-9.61(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(2-chlorobenzoyl)amino]phenyl] 3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanoate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC

DOS

IR

Vibrations