Geometry & MOs

Info

ID:	261267
PubChem CID:	103224617
Reduced:	N2O3C12H22 (1)
Stoich.:	A2B3C12D22 (1)
Weight, g/mol:	218.126657
ΔH_f, kcal/mol:	-111.97
Dipole, Da:	5.49
IP(EA), eV:	-8.59(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid

Drug info:

PubChemData

Smile

COCC(C(=O)O)N1CCN(CC1)CC2CC2

DOS

IR

Vibrations