Geometry & MOs

Info

ID:	674
PubChem CID:	3176
Reduced:	N3O7C25H25 (1)
Stoich.:	A3B7C25D25 (1)
Weight, g/mol:	479.16925
ΔH_f, kcal/mol:	-197.27
Dipole, Da:	3.7
IP(EA), eV:	-8.18(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-hydroxy-8-methyl-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=C(N3)C(=O)OC)O)C(=O)C4=CC5=CC(=C(C(=C5N4)OC)OC)OC

DOS

IR

Vibrations