Geometry & MOs

Info

ID:

223915

PubChem CID:

85335769

Reduced:

O11C40H58 (1)

Stoich.:

A11B40C58 (1)

Weight, g/mol:

715.933431

ΔHf, kcal/mol:

-539.33

Dipole, Da:

8.98

IP(EA), eV:

 -9.52(-0.11)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tripotassium;[4-[[3-[5-(dithiolan-3-yl)pentanoyloxy]-2-hydroxypropoxy]-oxidophosphoryl]oxy-2,3,5,6-tetrahydroxycyclohexyl] phosphate

Drug info:

PubChemData

Smile

CC1C2CCC3(C(C2(CCC1OC4C=CC(C(O4)OC(=O)C)OC(=O)C)C)C(=O)CC5C3(CC(C5=C(CCCC(C)C)C(=O)O)OC(=O)C)C)C

DOS

IR

Vibrations