Geometry & MOs

Info

ID:	427855
PubChem CID:	135164461
Reduced:	NO3C12H17 (2)
Stoich.:	AB3C12D17 (2)
Weight, g/mol:	652.287849
ΔH_f, kcal/mol:	-278.83
Dipole, Da:	2.33
IP(EA), eV:	-8.49(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(4-carbazol-9-ylphenyl)phenyl]-11,11-dimethyl-N-phenylbenzo[b]fluoren-3-amine

Drug info:

PubChemData

Smile

CCOC(=O)C(C(C)C(CC1=CNC2=CC=CC=C21)NC(=O)OC(C)(C)C)C(=O)OCC

DOS

IR

Vibrations