Geometry & MOs

Info

ID:	258878
PubChem CID:	103157306
Reduced:	N2O5C9H18 (1)
Stoich.:	A2B5C9D18 (1)
Weight, g/mol:	244.142307
ΔH_f, kcal/mol:	-227.18
Dipole, Da:	2.58
IP(EA), eV:	-9.78(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-4-[[(3S)-piperidine-3-carbonyl]amino]butanoic acid

Drug info:

PubChemData

Smile

COCC(C(=O)NCC(CC(=O)O)OC)N

DOS

IR

Vibrations