Geometry & MOs

Info

ID:	315593
PubChem CID:	126628054
Reduced:	BrNSH24C40 (1)
Stoich.:	ABCD24E40 (1)
Weight, g/mol:	523.09356
ΔH_f, kcal/mol:	176.09
Dipole, Da:	1.92
IP(EA), eV:	-8.19(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(3-bromophenyl)phenyl]-9-naphthalen-2-ylcarbazole

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC3=C2C4=C(S3)C=CC(=C4)N5C6=CC=CC=C6C7=C5C=C(C=C7)C8=CC=CC=C8C9=CC=CC=C9Br

DOS

IR

Vibrations