Geometry & MOs

Info

ID:	88978
PubChem CID:	49958463
Reduced:	N3O4H11C15 (1)
Stoich.:	A3B4C11D15 (1)
Weight, g/mol:	353.101171
ΔH_f, kcal/mol:	33.75
Dipole, Da:	5.68
IP(EA), eV:	-9.1(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-(2-nitrophenyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OCC2=NN=C(O2)C3=CC=CC=C3[N+](=O)[O-]

DOS

IR

Vibrations