Geometry & MOs

Info

ID:	311887
PubChem CID:	126598845
Reduced:	N2H40C45 (1)
Stoich.:	A2B40C45 (1)
Weight, g/mol:	658.334799
ΔH_f, kcal/mol:	122.81
Dipole, Da:	2.91
IP(EA), eV:	-7.97(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,2,2,3,3-hexamethyl-9-naphthalen-1-yl-6-(9-phenylcarbazol-3-yl)cyclopenta[b]carbazole

Drug info:

PubChemData

Smile

CC1(C2=C(C=C3C(=C2)C4=C(N3C5=CC=CC=C5)C=CC(=C4)C6=CC7=C(C=C6)C8=CC=CC=C8N7C9=CC=CC=C9)C(C1(C)C)(C)C)C

DOS

IR

Vibrations