Geometry & MOs

Info

ID:	18418
PubChem CID:	540680
Reduced:	BO3C6H9 (2)
Stoich.:	AB3C6D9 (2)
Weight, g/mol:	280.128949
ΔH_f, kcal/mol:	-365.81
Dipole, Da:	0.08
IP(EA), eV:	-10.44(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dibutyl-[1,3,2]dioxaborinino[5,4-d][1,3,2]dioxaborinine-4,8-dione

Drug info:

PubChemData

Smile

B1(OC2=C(C(=O)O1)OB(OC2=O)CCCC)CCCC

DOS

IR

Vibrations