Geometry & MOs

Info

ID:	70283
PubChem CID:	48413137
Reduced:	SN3O5C20H21 (1)
Stoich.:	AB3C5D20E21 (1)
Weight, g/mol:	416.115441
ΔH_f, kcal/mol:	-97.35
Dipole, Da:	3.34
IP(EA), eV:	-9.74(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-methyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)propyl]-1-(4-nitrophenyl)methanesulfonamide

Drug info:

PubChemData

Smile

CC(C)C(C1=NC(=NO1)C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)OC

DOS

IR

Vibrations