Geometry & MOs

Info

ID:	188201
PubChem CID:	77681142
Reduced:	N2O2C12H17 (2)
Stoich.:	A2B2C12D17 (2)
Weight, g/mol:	202.131742
ΔH_f, kcal/mol:	-149.33
Dipole, Da:	4.7
IP(EA), eV:	-9.27(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methoxypropylamino)pyrrolidine-1-carboxylic acid

Drug info:

PubChemData

Smile

CCCCCCCNC(=O)N(C)C1=NC=CC(=N1)C2=CC=C(C=C2)C(CC(=O)O)OCC

DOS

IR

Vibrations