Geometry & MOs

Info

ID:

385051

PubChem CID:

134978212

Reduced:

NPO5C17H38 (1)

Stoich.:

ABC5D17E38 (1)

Weight, g/mol:

562.060107

ΔHf, kcal/mol:

-315.15

Dipole, Da:

12.64

IP(EA), eV:

 -9.38(-0.29)

Spin(Sz, S2):

 None, None

Charge, e:

 -2

Chem-info

IUPAC name:

[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphoryl] [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] phosphate

Drug info:

PubChemData

Smile

CCOCCCCCCCCCCOP(=O)([O-])OCC[N+](C)(C)C

DOS

IR

Vibrations