Geometry & MOs

Info

ID:

407634

PubChem CID:

135080383

Reduced:

O2N3C11H11 (1)

Stoich.:

A2B3C11D11 (1)

Weight, g/mol:

214.117777

ΔHf, kcal/mol:

47.09

Dipole, Da:

8.23

IP(EA), eV:

-9.24(-2.32)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C/C(=C(\C)/NO)/C1=C2C=CC=NC2=NC1=O

DOS

IR

Vibrations