Geometry & MOs

Info

ID:	268009
PubChem CID:	103595315
Reduced:	NOSF2C12H13 (1)
Stoich.:	ABCD2E12F13 (1)
Weight, g/mol:	265.11365
ΔH_f, kcal/mol:	-100.14
Dipole, Da:	4.13
IP(EA), eV:	-8.47(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methoxy-5-methylphenyl)-(4-methylthiomorpholin-3-yl)methanone

Drug info:

PubChemData

Smile

CN1CCSCC1C(=O)C2=C(C=CC(=C2)F)F

DOS

IR

Vibrations