Geometry & MOs

Info

ID:	239985
PubChem CID:	93375482
Reduced:	N2O3C12H22 (1)
Stoich.:	A2B3C12D22 (1)
Weight, g/mol:	242.163043
ΔH_f, kcal/mol:	-148.22
Dipole, Da:	4.31
IP(EA), eV:	-9.33(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R)-2-methyl-3-[methyl-[(3R)-piperidine-3-carbonyl]amino]propanoate

Drug info:

PubChemData

Smile

C[C@H](CN(C)C(=O)[C@@H]1CCCCN1)C(=O)OC

DOS

IR

Vibrations