Geometry & MOs

Info

ID:	410253
PubChem CID:	135083044
Reduced:	PN2O9C10H15 (1)
Stoich.:	AB2C9D10E15 (1)
Weight, g/mol:	338.051517
ΔH_f, kcal/mol:	-447.42
Dipole, Da:	6.08
IP(EA), eV:	-9.95(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CN(C(=O)NC1=O)C[C@H]2[C@@H]([C@@H]([C@H](O2)CO)OP(=O)(O)O)O

DOS

IR

Vibrations