Geometry & MOs

Info

ID:	120880
PubChem CID:	50748300
Reduced:	O3N4C22H26 (1)
Stoich.:	A3B4C22D26 (1)
Weight, g/mol:	423.190654
ΔH_f, kcal/mol:	-51.17
Dipole, Da:	7.57
IP(EA), eV:	-9.22(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-acetamidophenyl)-3-[3-(6-methyl-2-oxo-1-propan-2-ylpyridin-3-yl)-1,2,4-oxadiazol-5-yl]propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C(=O)N1C(C)C)C2=NOC(=N2)CCC(=O)NCCC3=CC=CC=C3

DOS

IR

Vibrations