Geometry & MOs

Info

ID:	278214
PubChem CID:	103834147
Reduced:	ClN2S2O3C8H11 (1)
Stoich.:	AB2C2D3E8F11 (1)
Weight, g/mol:	265.02879
ΔH_f, kcal/mol:	-96.16
Dipole, Da:	2.88
IP(EA), eV:	-9.72(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1-(5-chloro-1-methylimidazol-4-yl)sulfonylpyrrolidin-3-ol

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)Cl)S(=O)(=O)N2CC[C@@H](C2)O

DOS

IR

Vibrations