Geometry & MOs

Info

ID:	342289
PubChem CID:	127265066
Reduced:	SO2N4H10C17 (1)
Stoich.:	AB2C4D10E17 (1)
Weight, g/mol:	338.101505
ΔH_f, kcal/mol:	68.53
Dipole, Da:	4.33
IP(EA), eV:	-9.43(-2.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-3-[[4-[2-(5-nitropyridin-2-yl)ethenyl]phenoxy]methyl]-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

C1=CC=NC(=C1)C2=NC=C(S2)C=CC3=C(C=CC(=N3)C(=O)O)C#N

DOS

IR

Vibrations