Geometry & MOs

Info

ID:	316053
PubChem CID:	126629817
Reduced:	NO4H31C49 (1)
Stoich.:	AB4C31D49 (1)
Weight, g/mol:	633.230394
ΔH_f, kcal/mol:	98.25
Dipole, Da:	0.26
IP(EA), eV:	-7.94(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-dibenzo-p-dioxin-1-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)dibenzofuran-3-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2(C3=CC=CC=C3C4=C2C=C(C=C4)N(C5=CC6=C(C=C5)OC7=CC=CC=C7O6)C8=C9C(=CC=C8)OC1=CC=CC=C1O9)C1=CC=CC=C1

DOS

IR

Vibrations