Geometry & MOs

Info

ID:	316037
PubChem CID:	126629728
Reduced:	O2N3H31C48 (1)
Stoich.:	A2B3C31D48 (1)
Weight, g/mol:	517.167794
ΔH_f, kcal/mol:	164.89
Dipole, Da:	3.57
IP(EA), eV:	-7.83(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-dibenzofuran-3-yl-N-(4-phenylphenyl)dibenzo-p-dioxin-2-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)N(C4=CC=C(C=C4)N5C6=CC=CC=C6C7=CC=CC=C75)C8=CC9=C(C=C8)OC1=CC=CC=C1O9)C1=CC=CC=C12

DOS

IR

Vibrations