Geometry & MOs

Info

ID:	201968
PubChem CID:	79610359
Reduced:	N2O3C16H30 (1)
Stoich.:	A2B3C16D30 (1)
Weight, g/mol:	292.145678
ΔH_f, kcal/mol:	-179.26
Dipole, Da:	2.82
IP(EA), eV:	-9.23(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(1-methylsulfonylpiperidin-3-yl)methylamino]propanoate

Drug info:

PubChemData

Smile

CCCCN(CCCC)C(=O)N1CCC(CC1)CC(=O)O

DOS

IR

Vibrations