Geometry & MOs

Info

ID:	83662
PubChem CID:	49859732
Reduced:	ClSP3N7O18C25H37 (1)
Stoich.:	ABC3D7E18F25G37 (1)
Weight, g/mol:	229.999168
ΔH_f, kcal/mol:	-883.29
Dipole, Da:	7.49
IP(EA), eV:	-9.83(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

[(3R,4S)-5-fluoro-3,4-dihydroxy-2-oxopentyl] phosphate

Drug info:

PubChemData

Smile

CC(C)(COP(=O)([O-])OP(=O)([O-])OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)([O-])[O-])[C@H](C(=O)NCCC(=O)NCCSC(=O)C[C@@H](CCl)O)O

DOS

IR

Vibrations