Geometry & MOs

Info

ID:	403635
PubChem CID:	135061083
Reduced:	BO2H9C12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	392.139119
ΔH_f, kcal/mol:	-177.23
Dipole, Da:	1.54
IP(EA), eV:	-8.69(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(1,3,2-benzodioxaborol-2-yl)-1-naphthalen-2-ylethyl]-1,3,2-benzodioxaborole

Drug info:

PubChemData

Smile

B1(OC2=CC=CC=C2O1)CC(B3OC4=CC=CC=C4O3)C5=CC=CC6=CC=CC=C65

DOS

IR

Vibrations