Geometry & MOs

Info

ID:	442099
PubChem CID:	135249799
Reduced:	ON3H31C42 (1)
Stoich.:	AB3C31D42 (1)
Weight, g/mol:	695.330048
ΔH_f, kcal/mol:	139.4
Dipole, Da:	1.49
IP(EA), eV:	-8.26(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-naphthalen-2-yl-7-phenyl-5-[3-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole

Drug info:

PubChemData

Smile

CC1(COC(=N1)C2=NC=C(C=C2)C3=CC4=C(C5=C(N4C6=CC=CC=C6)C=C(C=C5)C7=CC8=CC=CC=C8C=C7)C9=CC=CC=C93)C

DOS

IR

Vibrations