Geometry & MOs

Info

ID:	173836
PubChem CID:	75690382
Reduced:	FSN3O3H16C21 (1)
Stoich.:	ABC3D3E16F21 (1)
Weight, g/mol:	364.091535
ΔH_f, kcal/mol:	-86.97
Dipole, Da:	4.48
IP(EA), eV:	-8.87(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-2-methylsulfanylpropanamide

Drug info:

PubChemData

Smile

C1=CC(=CC2=C1C=CN2)C(=O)NCCN3C(=O)C(=CC4=CC=C(C=C4)F)SC3=O

DOS

IR

Vibrations