Geometry & MOs

Info

ID:	394844
PubChem CID:	135023935
Reduced:	PN2S2O9C13H21 (1)
Stoich.:	AB2C2D9E13F21 (1)
Weight, g/mol:	351.059342
ΔH_f, kcal/mol:	-437.29
Dipole, Da:	8.41
IP(EA), eV:	-8.97(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC[C@@H]1C(C([C@@H](O1)N2C=CC(=O)NC2=O)OCSSC)OP(=O)(O)OC

DOS

IR

Vibrations