Geometry & MOs

Info

ID:	178089
PubChem CID:	76275324
Reduced:	FSN3O4C26H28 (1)
Stoich.:	ABC3D4E26F28 (1)
Weight, g/mol:	459.182792
ΔH_f, kcal/mol:	-148.24
Dipole, Da:	6.43
IP(EA), eV:	-9.09(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-acetamidophenyl)sulfonylamino]-N-[(4-phenyloxan-4-yl)methyl]propanamide

Drug info:

PubChemData

Smile

C1CCC(C1)OC2=NC=CC(=C2)CNC(=O)C(CC3=CC=CC=C3)NS(=O)(=O)C4=CC=CC=C4F

DOS

IR

Vibrations