Geometry & MOs

Info

ID:	413468
PubChem CID:	135086417
Reduced:	N2O5H24C26 (1)
Stoich.:	A2B5C24D26 (1)
Weight, g/mol:	553.9776
ΔH_f, kcal/mol:	-105.5
Dipole, Da:	3.61
IP(EA), eV:	-8.16(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-bromo-1-(7-bromo-6-methoxy-4,9-dihydro-3H-pyrido[3,4-b]indol-1-yl)-6-methoxy-9H-pyrido[3,4-b]indole

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)C=C(N2CC3=CC=CC=C3)C(=O)NCC(=O)C4=CC=C(C=C4)O)OC

DOS

IR

Vibrations