Geometry & MOs

Info

ID:	427824
PubChem CID:	135163657
Reduced:	FN3O3C21H32 (1)
Stoich.:	AB3C3D21E32 (1)
Weight, g/mol:	276.147393
ΔH_f, kcal/mol:	-164.74
Dipole, Da:	4.61
IP(EA), eV:	-8.32(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl (3S)-3-(methylcarbamoyl)piperidine-2-carboxylate

Drug info:

PubChemData

Smile

COC1C(=CC=CN1)C2CCN(CC2)C3CC4(C3)CCN(C4)C(=O)OCCF

DOS

IR

Vibrations