Geometry & MOs

Info

ID:	442446
PubChem CID:	135252138
Reduced:	NOH27C41 (1)
Stoich.:	ABC27D41 (1)
Weight, g/mol:	639.242296
ΔH_f, kcal/mol:	142.19
Dipole, Da:	1.64
IP(EA), eV:	-8.08(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-6-phenylindolo[2,3-b]indole

Drug info:

PubChemData

Smile

CC1=C2C=CC=C(C2=C(C=C1)C3=CC=CC4=C3OC5=CC=CC=C45)C6=CC=CC7=C6N(C8=CC=CC=C78)C9=CC=CC=C9

DOS

IR

Vibrations