Geometry & MOs

Info

ID:	130729
PubChem CID:	51096969
Reduced:	N2O2C15H18 (1)
Stoich.:	A2B2C15D18 (1)
Weight, g/mol:	332.221226
ΔH_f, kcal/mol:	-10.94
Dipole, Da:	5.92
IP(EA), eV:	-8.79(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(cyclohexylmethyl)piperidin-4-yl]-2-(2-oxopyrimidin-1-yl)acetamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)OCC(=O)N(CC#N)C2CC2

DOS

IR

Vibrations