Geometry & MOs

Info

ID:	298230
PubChem CID:	117648091
Reduced:	N5H39C59 (1)
Stoich.:	A5B39C59 (1)
Weight, g/mol:	553.251798
ΔH_f, kcal/mol:	303.25
Dipole, Da:	0.34
IP(EA), eV:	-7.63(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-bis(4-methylphenyl)-5,10-diphenylindolo[3,2-b]indol-3-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC4=C(C=C3)N(C5=C4N(C6=C5C=C(C=C6)N7C8=CC=CC=C8C9=CC=CC=C97)C1=CC2=CC=CC=C2C=C1)C1=CC=C(C=C1)C1=CC=CC=N1

DOS

IR

Vibrations