Geometry & MOs

Info

ID:	335882
PubChem CID:	127254744
Reduced:	O3N5H19C22 (1)
Stoich.:	A3B5C19D22 (1)
Weight, g/mol:	278.101505
ΔH_f, kcal/mol:	69.74
Dipole, Da:	15.24
IP(EA), eV:	-8.22(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4-oxo-1H-pyridine-2-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C(=C(C=C1)C2=CC=NC3=N/C(=C/4\C=NC5=CC=CC=C54)/NN23)OC)OC

DOS

IR

Vibrations