Geometry & MOs

Info

ID:	261279
PubChem CID:	103224906
Reduced:	N2O3C12H24 (1)
Stoich.:	A2B3C12D24 (1)
Weight, g/mol:	217.131408
ΔH_f, kcal/mol:	-126.68
Dipole, Da:	3.61
IP(EA), eV:	-8.63(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(hydroxymethyl)-3-methylpyrrolidin-1-yl]-3-methoxypropanoic acid

Drug info:

PubChemData

Smile

CN(C)C1(CCC1)CN(C)C(COC)C(=O)O

DOS

IR

Vibrations