Geometry & MOs

Info

ID:

84462

PubChem CID:

49866515

Reduced:

P4C17O22H36 (1)

Stoich.:

A4B17C22D36 (1)

Weight, g/mol:

321.054829

ΔHf, kcal/mol:

-1292.25

Dipole, Da:

7.86

IP(EA), eV:

 -10.78(-0.39)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(2R,3S,5R)-5-[(5R)-6-amino-5-methyl-2-oxo-4,5-dihydropyrimidin-3-yl]-3-hydroxythiolan-2-yl]methoxy-oxido-oxophosphanium

Drug info:

PubChemData

Smile

CCC[C@@H](O)O[C@H](COC(=O)CCC)COP(=O)(O)OC1[C@@H]([C@H](C([C@H]([C@H]1O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)O

DOS

IR

Vibrations