Geometry & MOs

Info

ID:	234014
PubChem CID:	92297539
Reduced:	O2Cl3N4H11C15 (1)
Stoich.:	A2B3C4D11E15 (1)
Weight, g/mol:	371.080515
ΔH_f, kcal/mol:	36.35
Dipole, Da:	2.67
IP(EA), eV:	-8.88(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(E)-[2-(4-fluorophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]-2-methoxyphenoxy]acetic acid

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)/C=N\NC2=NC(=C(C=C2Cl)Cl)Cl)OCC#N

DOS

IR

Vibrations