Geometry & MOs

Info

ID:	121062
PubChem CID:	50754454
Reduced:	SO2N4C16H16 (1)
Stoich.:	AB2C4D16E16 (1)
Weight, g/mol:	342.115047
ΔH_f, kcal/mol:	13.54
Dipole, Da:	3.38
IP(EA), eV:	-9.18(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-methyl-5-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,3-thiazol-2-yl]butanamide

Drug info:

PubChemData

Smile

CCC(=O)NC1=NC(=C(S1)C2=NC(=NO2)C3=CC=C(C=C3)C)C

DOS

IR

Vibrations