Geometry & MOs

Info

ID:	316052
PubChem CID:	126629816
Reduced:	NO3H27C42 (1)
Stoich.:	AB3C27D42 (1)
Weight, g/mol:	697.225308
ΔH_f, kcal/mol:	94.03
Dipole, Da:	0.81
IP(EA), eV:	-8.12(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-dibenzo-p-dioxin-1-yl-N-(9,9-diphenylfluoren-2-yl)dibenzo-p-dioxin-2-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=CC(=C2)N(C3=CC4=C(C=C3)C5=CC=CC=C5O4)C6=C7C(=CC=C6)OC8=CC=CC=C8O7)C9=CC=CC=C9

DOS

IR

Vibrations