Geometry & MOs

Info

ID:	220493
PubChem CID:	85195565
Reduced:	NO4C11H17 (1)
Stoich.:	AB4C11D17 (1)
Weight, g/mol:	227.115758
ΔH_f, kcal/mol:	-114.34
Dipole, Da:	5.11
IP(EA), eV:	-10.46(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(carboxymethyl)-4-methyl-4-prop-1-en-2-ylpyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

C1C2CC3(CC1CC(C2)(C3)O[N+](=O)[O-])CO

DOS

IR

Vibrations