Geometry & MOs

Info

ID:

334103

PubChem CID:

127252655

Reduced:

N2O5H24C26 (1)

Stoich.:

A2B5C24D26 (1)

Weight, g/mol:

345.100108

ΔHf, kcal/mol:

-82.76

Dipole, Da:

4.24

IP(EA), eV:

-8.27(-1.26)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3,4-dimethoxy-6-prop-2-ynylindeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

CN(C)C(CN1C2=C(C3=C(C1=O)C(=C(C=C3)OC)OC)C(=O)C4=CC=CC=C42)C5=CC=CO5

DOS

IR

Vibrations