Geometry & MOs

Info

ID:	142144
PubChem CID:	52990119
Reduced:	SO2N5C16H23 (1)
Stoich.:	AB2C5D16E23 (1)
Weight, g/mol:	329.177313
ΔH_f, kcal/mol:	-9.88
Dipole, Da:	5.47
IP(EA), eV:	-8.78(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-methylsulfonylpiperidin-4-yl)-(2-propan-2-yliminopiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1C(C(NN1)C)S(=O)(=O)NC(C2=CC=CC=C2)C3=NC=CN3C

DOS

IR

Vibrations