Geometry & MOs

Info

ID:	121063
PubChem CID:	50754455
Reduced:	SO2N4C17H18 (1)
Stoich.:	AB2C4D17E18 (1)
Weight, g/mol:	404.130697
ΔH_f, kcal/mol:	8.1
Dipole, Da:	3.6
IP(EA), eV:	-9.16(-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]-3-phenylpropanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations