Geometry & MOs

Info

ID:	364278
PubChem CID:	127315360
Reduced:	N2S3O4C15H22 (1)
Stoich.:	A2B3C4D15E22 (1)
Weight, g/mol:	247.124215
ΔH_f, kcal/mol:	-149.13
Dipole, Da:	3.89
IP(EA), eV:	-8.8(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-(4-methylpiperidin-1-yl)-2-methylsulfonylpropan-1-one

Drug info:

PubChemData

Smile

CC1(CCOC1)CNC(=O)C2=C(C=CS2)S(=O)(=O)N3CCSCC3

DOS

IR

Vibrations