Geometry & MOs

Info

ID:	203855
PubChem CID:	79883304
Reduced:	NF2O3C15H19 (1)
Stoich.:	AB2C3D15E19 (1)
Weight, g/mol:	257.052193
ΔH_f, kcal/mol:	-184.01
Dipole, Da:	2.74
IP(EA), eV:	-9.06(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-fluoro-2-hydroxyphenyl)-(1-oxo-1,4-thiazinan-4-yl)methanone

Drug info:

PubChemData

Smile

COC(=O)CCCOC1=C(C=C(C=C1F)CNC2CC2)F

DOS

IR

Vibrations