Geometry & MOs

Info

ID:	360826
PubChem CID:	127301478
Reduced:	SN2O2C10H22 (1)
Stoich.:	AB2C2D10E22 (1)
Weight, g/mol:	320.119464
ΔH_f, kcal/mol:	-108.45
Dipole, Da:	3.74
IP(EA), eV:	-9.44(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCNS(=O)(=O)N(C)C1CCC(CC1)C

DOS

IR

Vibrations