Geometry & MOs

Info

ID:	378662
PubChem CID:	134224756
Reduced:	NH35C50 (1)
Stoich.:	AB35C50 (1)
Weight, g/mol:	725.30825
ΔH_f, kcal/mol:	211.77
Dipole, Da:	1.31
IP(EA), eV:	-8.19(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[4-[4-[2-(3-phenylphenyl)-2-triphenylen-2-ylethyl]phenyl]phenyl]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)/C=C(\C3=CC=C(C=C3)C4=CC=CC=C4)/C5=CC=C(C=C5)C6=CC=C(C=C6)N7C8=CC=CC=C8C9=CC=CC=C97

DOS

IR

Vibrations