Geometry & MOs

Info

ID:	314501
PubChem CID:	126621945
Reduced:	BrH11C17 (1)
Stoich.:	AB11C17 (1)
Weight, g/mol:	441.129969
ΔH_f, kcal/mol:	66.57
Dipole, Da:	2.05
IP(EA), eV:	-8.65(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-pyrido[4,3-b]indol-5-ylphenyl)dibenzothiophen-2-amine

Drug info:

PubChemData

Smile

C1C2=CC=CC=C2C3=C1C4=C(C=C3)C=C(C=C4)Br

DOS

IR

Vibrations