Geometry & MOs

Info

ID:	142852
PubChem CID:	53102479
Reduced:	SN2O6C25H26 (1)
Stoich.:	AB2C6D25E26 (1)
Weight, g/mol:	417.168856
ΔH_f, kcal/mol:	-156.54
Dipole, Da:	9.53
IP(EA), eV:	-8.57(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-methyl-1-[3-[4-(4-methylphenoxy)phenyl]-1,2,4-oxadiazol-5-yl]propyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(=O)N2CCC3=C2C=C(C=C3)CNS(=O)(=O)C4=CC(=C(C=C4)OC)OC

DOS

IR

Vibrations