Geometry & MOs

Info

ID:	57126
PubChem CID:	22395368
Reduced:	O3C8H10 (1)
Stoich.:	A3B8C10 (1)
Weight, g/mol:	269.072179
ΔH_f, kcal/mol:	-126.3
Dipole, Da:	3.48
IP(EA), eV:	-10.56(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methoxyphenyl)sulfonylpiperidin-4-one

Drug info:

PubChemData

Smile

C1CC(=O)CCC1=CC(=O)O

DOS

IR

Vibrations