Geometry & MOs

Info

ID:	137400
PubChem CID:	52204148
Reduced:	ClSN2O3H15C17 (1)
Stoich.:	ABC2D3E15F17 (1)
Weight, g/mol:	345.139865
ΔH_f, kcal/mol:	-28.29
Dipole, Da:	5.78
IP(EA), eV:	-9.55(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-phenyl-2-[(4-propan-2-ylphenyl)methylsulfonyl]propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NOC(=N2)CS(=O)(=O)CC3=CC(=CC=C3)Cl

DOS

IR

Vibrations