Geometry & MOs

Info

ID:	297291
PubChem CID:	117614617
Reduced:	F2N2H4C9 (1)
Stoich.:	A2B2C4D9 (1)
Weight, g/mol:	642.134224
ΔH_f, kcal/mol:	-9.64
Dipole, Da:	3.41
IP(EA), eV:	-10.86(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-carbazol-9-yl-9-[2-(2,3,4,5,6-pentafluorophenyl)-6-(trifluoromethyl)phenyl]carbazole

Drug info:

PubChemData

Smile

CC1=C(C(=CC(=C1F)C#N)C#N)F

DOS

IR

Vibrations