Geometry & MOs

Info

ID:	337579
PubChem CID:	127258202
Reduced:	N5O7C13H17 (1)
Stoich.:	A5B7C13D17 (1)
Weight, g/mol:	336.062737
ΔH_f, kcal/mol:	-224.84
Dipole, Da:	10.37
IP(EA), eV:	-9.46(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3R,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-4-methoxyoxolan-2-yl]methyl methanesulfonate

Drug info:

PubChemData

Smile

COC(=O)CO[C@@H]1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC(=NC3=O)N)CO)O

DOS

IR

Vibrations