Geometry & MOs

Info

ID:	82074
PubChem CID:	49855564
Reduced:	ON2H6C8 (2)
Stoich.:	AB2C6D8 (2)
Weight, g/mol:	312.085855
ΔH_f, kcal/mol:	61.75
Dipole, Da:	7.4
IP(EA), eV:	-8.56(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methoxyphenyl)-5-(4-nitrophenyl)-1,3,4-oxadiazol-2-amine

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)NC2=NN=C(O2)C3=CC=C(C=C3)C#N

DOS

IR

Vibrations