Geometry & MOs

Info

ID:	360880
PubChem CID:	127301534
Reduced:	SN3O3C14H25 (1)
Stoich.:	AB3C3D14E25 (1)
Weight, g/mol:	336.114378
ΔH_f, kcal/mol:	-90.24
Dipole, Da:	4.88
IP(EA), eV:	-8.78(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCN1CCC(CC1)CNS(=O)(=O)CC2=CC(=NO2)C

DOS

IR

Vibrations