Geometry & MOs

Info

ID:	240635
PubChem CID:	93616894
Reduced:	NSO3C13H17 (1)
Stoich.:	ABC3D13E17 (1)
Weight, g/mol:	255.092915
ΔH_f, kcal/mol:	-117.72
Dipole, Da:	5.57
IP(EA), eV:	-8.95(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(3,4-dimethylphenyl)-2-methylsulfonylpropanamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)N1CCCC2=CC=CC=C21)S(=O)(=O)C

DOS

IR

Vibrations