Geometry & MOs

Info

ID:

19409

PubChem CID:

563180

Reduced:

N2O4H18C19 (1)

Stoich.:

A2B4C18D19 (1)

Weight, g/mol:

338.126657

ΔHf, kcal/mol:

-8.72

Dipole, Da:

7.15

IP(EA), eV:

-9.25(-1.42)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

8-nitro-6-(3-phenylmethoxypropoxy)quinoline

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COCCCOC2=CC(=C3C(=C2)C=CC=N3)[N+](=O)[O-]

DOS

IR

Vibrations