Geometry & MOs

Info

ID:	298217
PubChem CID:	117648068
Reduced:	N3H35C52 (1)
Stoich.:	A3B35C52 (1)
Weight, g/mol:	801.314398
ΔH_f, kcal/mol:	250.02
Dipole, Da:	0.65
IP(EA), eV:	-7.64(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dinaphthalen-2-yl-10-phenanthren-9-yl-5,8-diphenylindolo[3,2-b]indol-3-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC3=C(C=C2)N(C4=C3N(C5=C4C=C(C=C5)N(C6=CC7=CC=CC=C7C=C6)C8=CC9=CC=CC=C9C=C8)C1=CC=CC=C1)C1=CC=CC=C1

DOS

IR

Vibrations