Geometry & MOs

Info

ID:	334565
PubChem CID:	127253240
Reduced:	N5O8C26H29 (1)
Stoich.:	A5B8C26D29 (1)
Weight, g/mol:	395.136887
ΔH_f, kcal/mol:	-211.66
Dipole, Da:	13.99
IP(EA), eV:	-8.05(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2,2-dimethoxyethyl)-3,4-dimethoxyindeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CN2C(=O)[C@@H](NC2=O)CCC(=O)N3C[C@H]4C[C@@H](C3)C5=CC=C(C(=O)N5C4)[N+](=O)[O-])OC

DOS

IR

Vibrations