Geometry & MOs

Info

ID:	314154
PubChem CID:	126620701
Reduced:	NOH37C56 (1)
Stoich.:	ABC37D56 (1)
Weight, g/mol:	865.370851
ΔH_f, kcal/mol:	208.29
Dipole, Da:	3.34
IP(EA), eV:	-8.1(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(9,9-dimethylfluoren-2-yl)-3,5-bis[4-(4-naphthalen-1-ylphenyl)phenyl]indole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC4=C(C=C3)N(C=C4C5=CC=C(C=C5)C6=CC=CC=C6)C7=CC=C(C=C7)C8=CC=CC9=C8OC1=C9C=CC=C1C1=CC=CC=C1

DOS

IR

Vibrations