Geometry & MOs

Info

ID:	84448
PubChem CID:	49866460
Reduced:	FPN4O7C10H12 (1)
Stoich.:	ABC4D7E10F12 (1)
Weight, g/mol:	190.084124
ΔH_f, kcal/mol:	-337.25
Dipole, Da:	10.44
IP(EA), eV:	-9.14(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3R,4R,6S)-4,6-dihydroxy-2-methyloxan-3-yl] acetate

Drug info:

PubChemData

Smile

C1=NC(=O)C2=C(N1)N(C=N2)[C@H]3[C@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)F

DOS

IR

Vibrations