Geometry & MOs

Info

ID:

413766

PubChem CID:

135086716

Reduced:

NO4H13C17 (1)

Stoich.:

AB4C13D17 (1)

Weight, g/mol:

254.105528

ΔHf, kcal/mol:

-69.19

Dipole, Da:

4.04

IP(EA), eV:

-8.82(-1.27)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

10-methyl-1,2,5,11a-tetrahydroindolizino[7,6-b]indole-3,11-dione

Drug info:

PubChemData

Smile

COC(=O)/C(=C\C1=CC=CO1)/C2=C(C3=CC=CC=C3N2)C=O

DOS

IR

Vibrations