Geometry & MOs

Info

ID:	203604
PubChem CID:	79850283
Reduced:	ClSN2O4C12H15 (1)
Stoich.:	ABC2D4E12F15 (1)
Weight, g/mol:	263.155515
ΔH_f, kcal/mol:	-148.67
Dipole, Da:	7.02
IP(EA), eV:	-8.89(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethyl-2-[methyl(2-methylsulfonylethyl)amino]cyclohexan-1-ol

Drug info:

PubChemData

Smile

CN(CCS(=O)(=O)C)C1=C(C=C2C(C(=O)NC2=C1)O)Cl

DOS

IR

Vibrations