Geometry & MOs

Info

ID:

89069

PubChem CID:

49959133

Reduced:

N2O3H14C16 (1)

Stoich.:

A2B3C14D16 (1)

Weight, g/mol:

402.05791

ΔHf, kcal/mol:

0.11

Dipole, Da:

3.9

IP(EA), eV:

-9.07(-1.38)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-[(2-bromo-4-ethylphenoxy)methyl]-5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCC2=NN=C(O2)/C=C/C3=CC=CO3

DOS

IR

Vibrations