Geometry & MOs

Info

ID:	278221
PubChem CID:	103834174
Reduced:	BrFNSO3C11H13 (1)
Stoich.:	ABCDE3F11G13 (1)
Weight, g/mol:	233.108565
ΔH_f, kcal/mol:	-144.08
Dipole, Da:	5.31
IP(EA), eV:	-9.71(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-cyclopentylsulfonylpyrrolidin-2-yl]methanol

Drug info:

PubChemData

Smile

C1C[C@H](N(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)F)CO

DOS

IR

Vibrations