Geometry & MOs

Info

ID:	311291
PubChem CID:	126590275
Reduced:	F2N3O3C33H37 (1)
Stoich.:	A2B3C3D33E37 (1)
Weight, g/mol:	688.287849
ΔH_f, kcal/mol:	-175.91
Dipole, Da:	5.17
IP(EA), eV:	-9.01(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-(9-cyclohexa-2,4-dien-1-ylcarbazol-3-yl)phenyl]-2-naphthalen-2-yl-9-phenylcarbazole

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=N1)C)C2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3)N4CCC5(CC4)CC5(F)F)CC(=O)OC(C)C

DOS

IR

Vibrations