Geometry & MOs

Info

ID:	318658
PubChem CID:	126652637
Reduced:	NH20C27 (2)
Stoich.:	AB20C27 (2)
Weight, g/mol:	600.256549
ΔH_f, kcal/mol:	375.74
Dipole, Da:	5.96
IP(EA), eV:	-6.91(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

12-[2-(2-carbazol-9-ylphenyl)phenyl]-7,7-dimethylindeno[1,2-a]carbazole

Drug info:

PubChemData

Smile

CC1(C2=C(C3=CC=CC=C31)C4=C(C=C2)C5=CC=CC=C5N4C6=CC=CC=C6C7=CC=CC=C7N8C9=CC=CC=C9C1=C8C2=C(C=C1)C(C1=CC=CC=C12)(C)C)C

DOS

IR

Vibrations