Geometry & MOs

Info

ID:	446764
PubChem CID:	135277540
Reduced:	NSH33C48 (1)
Stoich.:	ABC33D48 (1)
Weight, g/mol:	563.224915
ΔH_f, kcal/mol:	202.34
Dipole, Da:	0.72
IP(EA), eV:	-8.02(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)dibenzofuran-3-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)N(C4=CC=C(C=C4)C5=CC=CC=C5)C6=C(C7=C(C=C6)C8=CC=CC=C8S7)C9=CC=CC=C9

DOS

IR

Vibrations