Geometry & MOs

Info

ID:	84447
PubChem CID:	49866459
Reduced:	FPN5O6C12H13 (1)
Stoich.:	ABC5D6E12F13 (1)
Weight, g/mol:	350.042764
ΔH_f, kcal/mol:	-268.16
Dipole, Da:	4.75
IP(EA), eV:	-9.16(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3R,4S,5R)-4-fluoro-3-hydroxy-5-(6-oxo-3H-purin-9-yl)oxolan-2-yl]methyl dihydrogen phosphate

Drug info:

PubChemData

Smile

C1=CN2C=NC3=C(C2=N1)N=CN3[C@H]4[C@H]([C@@H]([C@H](O4)COP(=O)(O)O)O)F

DOS

IR

Vibrations