Geometry & MOs

Info

ID:	251132
PubChem CID:	103101689
Reduced:	FSN3O3C11H16 (1)
Stoich.:	ABC3D3E11F16 (1)
Weight, g/mol:	272.094312
ΔH_f, kcal/mol:	-149.66
Dipole, Da:	4.57
IP(EA), eV:	-9.66(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[6-(aminomethyl)pyridin-3-yl]sulfonyl-ethylamino]acetamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)S(=O)(=O)C1=CC=CC(=C1CN)F

DOS

IR

Vibrations