Geometry & MOs

Info

ID:

21381

PubChem CID:

588067

Reduced:

B4O11C20H34 (1)

Stoich.:

A4B11C20D34 (1)

Weight, g/mol:

494.247333

ΔHf, kcal/mol:

-733.79

Dipole, Da:

2.03

IP(EA), eV:

 -10.28(0.91)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-ethyl-6-(2-ethyl-1,3,2-dioxaborolan-4-yl)-4-[[2-ethyl-6-(2-ethyl-1,3,2-dioxaborolan-4-yl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaborol-4-yl]oxy]-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaborole

Drug info:

PubChemData

Smile

B1(OCC(O1)C2C3C(C(O2)OC4C5C(C(O4)C6COB(O6)CC)OB(O5)CC)OB(O3)CC)CC

DOS

IR

Vibrations