Geometry & MOs

Info

ID:

334048

PubChem CID:

127252600

Reduced:

N3O4H23C29 (1)

Stoich.:

A3B4C23D29 (1)

Weight, g/mol:

494.197235

ΔHf, kcal/mol:

-72.56

Dipole, Da:

5.15

IP(EA), eV:

 -8.83(-1.46)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-[[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl]-3,4-dimethoxyindeno[1,2-c]isoquinoline-5,11-dione;hydrochloride

Drug info:

PubChemData

Smile

C1[C@@H]2CN(C[C@H]1C3=CC=CC(=O)N3C2)C(=O)CN4C5=C(C6=CC=CC=C6C4=O)C(=O)C7=CC=CC=C75

DOS

IR

Vibrations