Geometry & MOs

Info

ID:	316047
PubChem CID:	126629765
Reduced:	NO4H21C36 (1)
Stoich.:	AB4C21D36 (1)
Weight, g/mol:	533.162708
ΔH_f, kcal/mol:	42.19
Dipole, Da:	1.51
IP(EA), eV:	-8.1(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-dibenzo-p-dioxin-2-yl-N-(4-phenylphenyl)dibenzo-p-dioxin-2-amine

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(O2)C=C(C=C3)N(C4=CC5=C(C=C4)C6=CC=CC=C6O5)C7=CC8=C(C=C7)OC9=CC=CC=C9O8

DOS

IR

Vibrations