Geometry & MOs

Info

ID:	294082
PubChem CID:	117426774
Reduced:	NSO3C13H19 (1)
Stoich.:	ABC3D13E19 (1)
Weight, g/mol:	269.108565
ΔH_f, kcal/mol:	-114.94
Dipole, Da:	7.01
IP(EA), eV:	-9.24(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxy-3-methylsulfonylphenyl)piperidine

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)S(=O)(=O)C)C2(CCCC2)N

DOS

IR

Vibrations