Geometry & MOs

Info

ID:	446774
PubChem CID:	135277597
Reduced:	NSH29C42 (1)
Stoich.:	ABC29D42 (1)
Weight, g/mol:	629.217721
ΔH_f, kcal/mol:	176.17
Dipole, Da:	1.45
IP(EA), eV:	-8.01(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(2-phenyldibenzothiophen-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-1-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)N(C4=CC=C(C=C4)C5=CC=CC=C5)C6=CC7=C(C=C6)C8=CC=CC=C8S7

DOS

IR

Vibrations