Geometry & MOs

Info

ID:

288738

PubChem CID:

104324735

Reduced:

NO3H13C14 (1)

Stoich.:

AB3C13D14 (1)

Weight, g/mol:

281.080041

ΔHf, kcal/mol:

-40.54

Dipole, Da:

5.41

IP(EA), eV:

-9.2(-0.99)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methoxy]-1-benzofuran-2-carbonitrile

Drug info:

PubChemData

Smile

C1CC(OC1)COC2=C(OC3=CC=CC=C32)C#N

DOS

IR

Vibrations