Geometry & MOs

Info

ID:	449075
PubChem CID:	135295823
Reduced:	BrOH17C28 (1)
Stoich.:	ABC17D28 (1)
Weight, g/mol:	448.04628
ΔH_f, kcal/mol:	95.86
Dipole, Da:	1.3
IP(EA), eV:	-8.8(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenyl)-8-naphthalen-1-yldibenzofuran

Drug info:

PubChemData

Smile

C=CC1=CC2=C(C=C1)C3=C(O2)C(=CC=C3)C4=C(C5=CC=CC=C5C6=CC=CC=C64)Br

DOS

IR

Vibrations