Geometry & MOs

Info

ID:	253808
PubChem CID:	103120751
Reduced:	ON4C13H18 (1)
Stoich.:	AB4C13D18 (1)
Weight, g/mol:	236.163711
ΔH_f, kcal/mol:	3.01
Dipole, Da:	6.04
IP(EA), eV:	-8.92(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-aminoethyl)piperidin-1-yl]-(1-methylpyrazol-3-yl)methanone

Drug info:

PubChemData

Smile

CCC(CNC(=O)C1=NN(C2=CC=CC=C21)C)N

DOS

IR

Vibrations