Geometry & MOs

Info

ID:	347816
PubChem CID:	127272878
Reduced:	NSO3C13H25 (1)
Stoich.:	ABC3D13E25 (1)
Weight, g/mol:	261.139865
ΔH_f, kcal/mol:	-168.54
Dipole, Da:	4.54
IP(EA), eV:	-9.58(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4-dimethyl-1-(oxolan-2-ylmethylsulfonyl)piperidine

Drug info:

PubChemData

Smile

CC1(CCN(CC1)S(=O)(=O)CC2CCCCO2)C

DOS

IR

Vibrations