Geometry & MOs

Info

ID:	360787
PubChem CID:	127301432
Reduced:	SN2O3C17H22 (1)
Stoich.:	AB2C3D17E22 (1)
Weight, g/mol:	335.130363
ΔH_f, kcal/mol:	-69.12
Dipole, Da:	2.6
IP(EA), eV:	-9.1(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NOC(=C1)CS(=O)(=O)NC(C)C2=CC3=C(CCCC3)C=C2

DOS

IR

Vibrations