Geometry & MOs

Info

ID:

410626

PubChem CID:

135083426

Reduced:

NOC7H7 (2)

Stoich.:

ABC7D7 (2)

Weight, g/mol:

420.13945

ΔHf, kcal/mol:

39.52

Dipole, Da:

5.04

IP(EA), eV:

-9.38(-0.53)

Spin(Sz, S2):

None, None

Charge, e:

-1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCN(C1=CC=C(C=C1)C2=CC=CC=C2)[N+](=O)[O-]

DOS

IR

Vibrations