Geometry & MOs

Info

ID:	129481
PubChem CID:	51072742
Reduced:	ClN2O2S2H9C10 (1)
Stoich.:	AB2C2D2E9F10 (1)
Weight, g/mol:	317.085242
ΔH_f, kcal/mol:	-27.74
Dipole, Da:	5.86
IP(EA), eV:	-8.66(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(4-chlorophenyl)sulfonylethyl]-2,6-dimethylmorpholine

Drug info:

PubChemData

Smile

CC1=CN=C(S1)NS(=O)(=O)C2=CC=CC=C2Cl

DOS

IR

Vibrations