Geometry & MOs

Info

ID:

673

PubChem CID:

3175

Reduced:

N3O8C26H27 (1)

Stoich.:

A3B8C26D27 (1)

Weight, g/mol:

509.179815

ΔHf, kcal/mol:

-239.47

Dipole, Da:

3.52

IP(EA), eV:

 -8.31(-1.01)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 4-hydroxy-2,8-dimethyl-1-oxo-6-(5,6,7-trimethoxy-1H-indole-2-carbonyl)-7,8-dihydro-3H-pyrrolo[3,2-e]indole-2-carboxylate

Drug info:

PubChemData

Smile

CC1CN(C2=CC(=C3C(=C12)C(=O)C(N3)(C)C(=O)OC)O)C(=O)C4=CC5=CC(=C(C(=C5N4)OC)OC)OC

DOS

IR

Vibrations