Geometry & MOs

Info

ID:	345039
PubChem CID:	127268799
Reduced:	NSO3C13H25 (1)
Stoich.:	ABC3D13E25 (1)
Weight, g/mol:	261.139865
ΔH_f, kcal/mol:	-164.8
Dipole, Da:	4.15
IP(EA), eV:	-9.62(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(oxolan-2-ylmethylsulfonyl)-2-propan-2-ylpyrrolidine

Drug info:

PubChemData

Smile

CC(C)C1CCCN1S(=O)(=O)CC2CCCCO2

DOS

IR

Vibrations