Geometry & MOs

Info

ID:	371963
PubChem CID:	131282717
Reduced:	N4C11H14 (1)
Stoich.:	A4B11C14 (1)
Weight, g/mol:	221.108565
ΔH_f, kcal/mol:	66.97
Dipole, Da:	3.34
IP(EA), eV:	-8.4(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-methylsulfonylpyrrolidin-3-yl)butan-2-ol

Drug info:

PubChemData

Smile

CC1=CC=C(N1C)C2=NN=CC(=C2)CN

DOS

IR

Vibrations