Geometry & MOs

Info

ID:	84820
PubChem CID:	49870175
Reduced:	SO5C28H50 (1)
Stoich.:	AB5C28D50 (1)
Weight, g/mol:	143.04949
ΔH_f, kcal/mol:	-211.43
Dipole, Da:	6.21
IP(EA), eV:	-9.45(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-diamino-3-fluoro-1H-pyridin-2-one

Drug info:

PubChemData

Smile

CCCCCCCCCCCCC#CC#CCCCCCCCCCOCCCOS(=O)(=O)O

DOS

IR

Vibrations