Geometry & MOs

Info

ID:	8496
PubChem CID:	78431
Reduced:	NSO2C12H17 (1)
Stoich.:	ABC2D12E17 (1)
Weight, g/mol:	239.098
ΔH_f, kcal/mol:	-71.38
Dipole, Da:	7.51
IP(EA), eV:	-9.22(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylphenyl)sulfonylpiperidine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

DOS

IR

Vibrations