Geometry & MOs

Info

ID:	370563
PubChem CID:	127339698
Reduced:	ON4C12H20 (1)
Stoich.:	AB4C12D20 (1)
Weight, g/mol:	300.158626
ΔH_f, kcal/mol:	-11.04
Dipole, Da:	2.08
IP(EA), eV:	-9.08(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2CCN(CC2)C(=O)N(C)C

DOS

IR

Vibrations