Geometry & MOs

Info

ID:	241005
PubChem CID:	93621094
Reduced:	SO2N3C18H21 (1)
Stoich.:	AB2C3D18E21 (1)
Weight, g/mol:	297.103479
ΔH_f, kcal/mol:	-62.26
Dipole, Da:	4.81
IP(EA), eV:	-8.83(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-3-methylsulfonyl-N-[[(2R)-oxolan-2-yl]methyl]benzamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC2=C(C=C1)NC(=O)CC2)NC(=O)NCCC3=CC=CS3

DOS

IR

Vibrations