Geometry & MOs

Info

ID:	260522
PubChem CID:	103194365
Reduced:	ClON4C12H17 (1)
Stoich.:	ABC4D12E17 (1)
Weight, g/mol:	237.15896
ΔH_f, kcal/mol:	-26.85
Dipole, Da:	2.69
IP(EA), eV:	-8.74(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-amino-1-methylpyrazol-3-yl)-N-methylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1CCCN(C1)C2=C(C=C(C=N2)Cl)N

DOS

IR

Vibrations