Geometry & MOs

Info

ID:	3473
PubChem CID:	9700
Reduced:	PN2O8C10H15 (1)
Stoich.:	AB2C8D10E15 (1)
Weight, g/mol:	322.056602
ΔH_f, kcal/mol:	-416.28
Dipole, Da:	4.46
IP(EA), eV:	-9.61(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(O)O)O

DOS

IR

Vibrations