Geometry & MOs

Info

ID:	226208
PubChem CID:	87350061
Reduced:	ClO2N3C12H16 (1)
Stoich.:	AB2C3D12E16 (1)
Weight, g/mol:	912.176134
ΔH_f, kcal/mol:	-92.36
Dipole, Da:	1.56
IP(EA), eV:	-9.3(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-aminophenyl)-2,3,5,6-tetra(dibenzothiophen-4-yl)aniline

Drug info:

PubChemData

Smile

C1CC(CCC1NC2=CC(=NC=C2C(=O)N)Cl)O

DOS

IR

Vibrations