Geometry & MOs

Info

ID:	446790
PubChem CID:	135277730
Reduced:	NSH35C51 (1)
Stoich.:	ABC35D51 (1)
Weight, g/mol:	745.243936
ΔH_f, kcal/mol:	190.51
Dipole, Da:	2.55
IP(EA), eV:	-8.01(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(2-dibenzofuran-2-yldibenzothiophen-3-yl)phenyl]-N-phenyl-4-(4-phenylphenyl)aniline

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C(C=C3)N(C4=CC5=C(C=C4)C6=CC=CC=C6C7=CC=CC=C75)C8=C(C=C9C1=CC=CC=C1SC9=C8)C1=CC=CC=C1)C

DOS

IR

Vibrations