Geometry & MOs

Info

ID:	394843
PubChem CID:	135023927
Reduced:	O4C11H12 (1)
Stoich.:	A4B11C12 (1)
Weight, g/mol:	444.04261
ΔH_f, kcal/mol:	-161.93
Dipole, Da:	3.63
IP(EA), eV:	-9.54(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C2CCC(C2=COC1=O)OC(=O)C

DOS

IR

Vibrations