Geometry & MOs

Info

ID:	360800
PubChem CID:	127301445
Reduced:	SN4O4C15H26 (1)
Stoich.:	AB4C4D15E26 (1)
Weight, g/mol:	335.130363
ΔH_f, kcal/mol:	-125.2
Dipole, Da:	4.96
IP(EA), eV:	-9.07(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CN1CCN(CC1)S(=O)(=O)CC2=CC(=NO2)C

DOS

IR

Vibrations