Geometry & MOs

Info

ID:	209607
PubChem CID:	80693915
Reduced:	FN3C8H16 (1)
Stoich.:	AB3C8D16 (1)
Weight, g/mol:	189.037211
ΔH_f, kcal/mol:	-41.07
Dipole, Da:	3.14
IP(EA), eV:	-8.98(1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-2-(2-fluoroethylsulfanyl)-1H-pyrimidin-4-one

Drug info:

PubChemData

Smile

C1CN(CCC1C(=N)N)CCF

DOS

IR

Vibrations