Geometry & MOs

Info

ID:	293121
PubChem CID:	117374265
Reduced:	NOC7H10 (2)
Stoich.:	ABC7D10 (2)
Weight, g/mol:	248.152478
ΔH_f, kcal/mol:	-77.88
Dipole, Da:	6.8
IP(EA), eV:	-8.2(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-4-(4-pyrrolidin-1-ylphenyl)butanoic acid

Drug info:

PubChemData

Smile

CN1CCCC2=C1C=CC(=C2)C(CCC(=O)O)N

DOS

IR

Vibrations