Geometry & MOs

Info

ID:

395326

PubChem CID:

135025200

Reduced:

N6H25C34 (1)

Stoich.:

A6B25C34 (1)

Weight, g/mol:

344.079707

ΔHf, kcal/mol:

280.72

Dipole, Da:

9.3

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 1.416705

Charge, e:

0

Chem-info

IUPAC name:

5,11-dihydroindolo[3,2-b]carbazole-6,12-dicarboxylic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CN2C=C(N=N2)C3=C(C(=C[C+]=C3)C4=CN(N=N4)CC5=CC=CC=C5)C6=CC=CC7=CC=CC=C76

DOS

IR

Vibrations