Geometry & MOs

Info

ID:	250940
PubChem CID:	103100235
Reduced:	ClNS2O3C11H14 (1)
Stoich.:	ABC2D3E11F14 (1)
Weight, g/mol:	280.994713
ΔH_f, kcal/mol:	-71.69
Dipole, Da:	3.85
IP(EA), eV:	-9.46(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-(5-chloro-4-methylthiophen-2-yl)sulfonylpyrrolidin-3-ol

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)S(=O)(=O)N2CC(C2)(C3CC3)O)Cl

DOS

IR

Vibrations