Geometry & MOs

Info

ID:	271935
PubChem CID:	103702643
Reduced:	ON6C10H14 (1)
Stoich.:	AB6C10D14 (1)
Weight, g/mol:	230.088912
ΔH_f, kcal/mol:	37.75
Dipole, Da:	7.79
IP(EA), eV:	-8.71(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[(6-fluoropyridin-2-yl)amino]ethylsulfanyl]propan-1-ol

Drug info:

PubChemData

Smile

CCN1C=NN=C1CNC2=NC=CN(C2=O)C

DOS

IR

Vibrations