Geometry & MOs

Info

ID:

59388

PubChem CID:

24847778

Reduced:

Cl2S2O4N7C15H17 (1)

Stoich.:

A2B2C4D7E15F17 (1)

Weight, g/mol:

1198.413951

ΔHf, kcal/mol:

3.48

Dipole, Da:

6.64

IP(EA), eV:

-8.75(-1.53)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[4,5-dihydroxy-2-(hydroxymethyl)-6-methoxyoxan-3-yl] [5-[5-[3-[3-[4,5-dihydroxy-2-(hydroxymethyl)-6-methoxyoxan-3-yl]oxy-3-hydroxypropoxy]-4-hydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-6-[[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)-2-methyloxan-3-yl] hydrogen phosphate

Drug info:

PubChemData

Smile

C1NC2=CC(=C(C=C2S(=O)(=O)N1)S(=O)(=O)N)Cl.C1=CC=C2C(=C1)C=NN=C2NN.Cl

DOS

IR

Vibrations