Geometry & MOs

Info

ID:	120873
PubChem CID:	50747708
Reduced:	O3N7H13C17 (1)
Stoich.:	A3B7C13D17 (1)
Weight, g/mol:	346.200491
ΔH_f, kcal/mol:	136.26
Dipole, Da:	9.13
IP(EA), eV:	-8.79(-2.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2C3=C(N=NC(=O)C3=NC4=NNNN24)C5=CC=CO5

DOS

IR

Vibrations