Geometry & MOs

Info

ID:	70277
PubChem CID:	48413129
Reduced:	SO3N5C18H23 (1)
Stoich.:	AB3C5D18E23 (1)
Weight, g/mol:	399.125277
ΔH_f, kcal/mol:	-25.13
Dipole, Da:	5.37
IP(EA), eV:	-9.69(-0.8)
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]-2,3-dihydro-1-benzofuran-5-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)S(=O)(=O)NC(C2=NC(=NO2)C3=CC=CC=C3)C(C)C

DOS

IR

Vibrations