Geometry & MOs

Info

ID:	273937
PubChem CID:	103805944
Reduced:	N2O2F3C10H17 (1)
Stoich.:	A2B2C3D10E17 (1)
Weight, g/mol:	235.132077
ΔH_f, kcal/mol:	-258.26
Dipole, Da:	3.11
IP(EA), eV:	-9.5(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(aminomethyl)piperidine-1-carbonyl]-1H-pyridin-2-one

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)COCC(F)(F)F)CN

DOS

IR

Vibrations