Geometry & MOs

Info

ID:

410252

PubChem CID:

135083043

Reduced:

SiN3O9C44H59 (1)

Stoich.:

AB3C9D44E59 (1)

Weight, g/mol:

338.051517

ΔHf, kcal/mol:

-295.31

Dipole, Da:

0.72

IP(EA), eV:

 -8.99(-0.15)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(2R,3S,4S,5S)-5-[(2,4-dioxopyrimidin-1-yl)methyl]-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] dihydrogen phosphate

Drug info:

PubChemData

Smile

CC1(O[C@H]2[C@@H](O1)[C@H](O[C@H]([C@@H]2OCC3=CC=CC=C3)C4[C@H](O[C@H]([C@@H]([C@@H]4OCC=C)N=[N+]=[N-])O[Si](C)(C)C(C)(C)C)COCC5=CC=CC=C5)OCC6=CC=CC=C6)C

DOS

IR

Vibrations