Geometry & MOs

Info

ID:	360757
PubChem CID:	127301402
Reduced:	FSN3O3C15H18 (1)
Stoich.:	ABC3D3E15F18 (1)
Weight, g/mol:	355.07574
ΔH_f, kcal/mol:	-85.79
Dipole, Da:	3.01
IP(EA), eV:	-8.52(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[4-(3-chlorophenyl)piperazin-1-yl]sulfonylmethyl]-3-methyl-1,2-oxazole

Drug info:

PubChemData

Smile

CC1=NOC(=C1)CS(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)F

DOS

IR

Vibrations