Geometry & MOs

Info

ID:	344784
PubChem CID:	127268372
Reduced:	SN3O4C15H25 (1)
Stoich.:	AB3C4D15E25 (1)
Weight, g/mol:	329.140927
ΔH_f, kcal/mol:	-126.96
Dipole, Da:	1.89
IP(EA), eV:	-8.99(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-[[4-(oxolan-2-ylmethylsulfonyl)piperazin-1-yl]methyl]-1,2-oxazole

Drug info:

PubChemData

Smile

CC1=CC(=NO1)CN2CCN(CC2)S(=O)(=O)CC3CCCCO3

DOS

IR

Vibrations