Geometry & MOs

Info

ID:	16833
PubChem CID:	477194
Reduced:	FN3O4C8H10 (1)
Stoich.:	AB3C4D8E10 (1)
Weight, g/mol:	231.065534
ΔH_f, kcal/mol:	-183.35
Dipole, Da:	3.39
IP(EA), eV:	-9.51(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-5-fluoro-1-[(2S,4S)-2-(hydroxymethyl)-1,3-dioxolan-4-yl]pyrimidin-2-one

Drug info:

PubChemData

Smile

C1[C@H](O[C@H](O1)CO)N2C=C(C(=NC2=O)N)F

DOS

IR

Vibrations