Geometry & MOs

Info

ID:	327901
PubChem CID:	126691272
Reduced:	SO3N4C15H20 (1)
Stoich.:	AB3C4D15E20 (1)
Weight, g/mol:	661.189792
ΔH_f, kcal/mol:	-83.27
Dipole, Da:	6.29
IP(EA), eV:	-8.63(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-dibenzothiophen-2-ylphenyl)-N-[4-(2,3-dimethylidene-1-benzothiophen-7-yl)phenyl]-4-phenylaniline

Drug info:

PubChemData

Smile

CCC1=C(C(=CC(=C1)C)N=C2N=C(C=C(N2N)C)C)S(=O)(=O)O

DOS

IR

Vibrations