Geometry & MOs

Info

ID:	360785
PubChem CID:	127301430
Reduced:	SN2O4C14H16 (1)
Stoich.:	AB2C4D14E16 (1)
Weight, g/mol:	341.086784
ΔH_f, kcal/mol:	-85.18
Dipole, Da:	2.35
IP(EA), eV:	-8.87(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NOC(=C1)CS(=O)(=O)NC2CCOC3=CC=CC=C23

DOS

IR

Vibrations