Geometry & MOs

Info

ID:	277619
PubChem CID:	103829943
Reduced:	FNO5C13H14 (1)
Stoich.:	ABC5D13E14 (1)
Weight, g/mol:	255.072928
ΔH_f, kcal/mol:	-236.5
Dipole, Da:	3.12
IP(EA), eV:	-9.61(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-fluoro-2-hydroxyphenyl)-(2-methylthiomorpholin-4-yl)methanone

Drug info:

PubChemData

Smile

COC(=O)C1CN(CCO1)C(=O)C2=C(C=C(C=C2)F)O

DOS

IR

Vibrations