Geometry & MOs

Info

ID:	258398
PubChem CID:	103153434
Reduced:	N2O5C14H18 (1)
Stoich.:	A2B5C14D18 (1)
Weight, g/mol:	230.126657
ΔH_f, kcal/mol:	-201.93
Dipole, Da:	5.62
IP(EA), eV:	-9.34(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-4-(pyrrolidine-1-carbonylamino)butanoic acid

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(C=C1)NC(=O)NCC(CC(=O)O)OC

DOS

IR

Vibrations