Geometry & MOs

Info

ID:	314142
PubChem CID:	126620583
Reduced:	NOH33C50 (1)
Stoich.:	ABC33D50 (1)
Weight, g/mol:	603.202071
ΔH_f, kcal/mol:	184.04
Dipole, Da:	2.85
IP(EA), eV:	-8.2(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-diphenyl-1-[4-(8-phenyldibenzothiophen-2-yl)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=CC=C7)C8=CC9=C(C=C8)OC1=CC=CC=C19

DOS

IR

Vibrations