Geometry & MOs

Info

ID:	70050
PubChem CID:	47207203
Reduced:	NSO3C13H19 (1)
Stoich.:	ABC3D13E19 (1)
Weight, g/mol:	269.108565
ΔH_f, kcal/mol:	-134.61
Dipole, Da:	3.41
IP(EA), eV:	-8.7(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dimethylphenyl)-2-ethylsulfonylpropanamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)C(C)C(=O)NC1=CC(=C(C=C1)C)C

DOS

IR

Vibrations