Geometry & MOs

Info

ID:	351186
PubChem CID:	127279744
Reduced:	SO3N4C11H16 (1)
Stoich.:	AB3C4D11E16 (1)
Weight, g/mol:	234.111676
ΔH_f, kcal/mol:	-85.06
Dipole, Da:	3.85
IP(EA), eV:	-9.54(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylpyrimidin-5-yl)-6-oxopiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NC=C(C=N1)NC(=O)CN2CCS(=O)(=O)CC2

DOS

IR

Vibrations