Geometry & MOs

Info

ID:	142551
PubChem CID:	53055945
Reduced:	FSN3O3C19H20 (1)
Stoich.:	ABC3D3E19F20 (1)
Weight, g/mol:	429.172228
ΔH_f, kcal/mol:	-70.75
Dipole, Da:	5.55
IP(EA), eV:	-9.7(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[2-[5-[(2-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl]ethyl]-4-propan-2-ylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=NC(=NO2)CCN(C)S(=O)(=O)C3=C(C=CC(=C3)F)C

DOS

IR

Vibrations