Geometry & MOs

Info

ID:

7532

PubChem CID:

73240

Reduced:

N7O8H33C37 (1)

Stoich.:

A7B8C33D37 (1)

Weight, g/mol:

703.239061

ΔHf, kcal/mol:

-168.21

Dipole, Da:

8.42

IP(EA), eV:

 -8.19(-0.93)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-hydroxy-2-[5-hydroxy-4-methoxy-2-(3-methyl-7-oxo-5,10-diazatetracyclo[7.4.0.01,12.02,6]trideca-2(6),3,8-triene-10-carbonyl)-7,8-dihydro-3H-pyrrolo[3,2-e]indole-6-carbonyl]-4-methoxy-7,8-dihydro-3H-pyrrolo[3,2-e]indole-6-carboxamide

Drug info:

PubChemData

Smile

CC1=CNC2=C1C34CC3CN(C4=CC2=O)C(=O)C5=CC6=C7CCN(C7=C(C(=C6N5)OC)O)C(=O)C8=CC9=C1CCN(C1=C(C(=C9N8)OC)O)C(=O)N

DOS

IR

Vibrations