Geometry & MOs

Info

ID:	342140
PubChem CID:	127264853
Reduced:	ClFON2H14C15 (1)
Stoich.:	ABCD2E14F15 (1)
Weight, g/mol:	343.13322
ΔH_f, kcal/mol:	-45.66
Dipole, Da:	4.3
IP(EA), eV:	-8.97(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-cyclopropyl-1,2-oxazole-5-carbonyl)-3-(4-fluoro-2-methylphenyl)piperazin-2-one

Drug info:

PubChemData

Smile

C1C(CN(C1C2=CC(=CC=C2)F)C3=C(C=NC=C3)Cl)O

DOS

IR

Vibrations