Geometry & MOs

Info

ID:	202809
PubChem CID:	79730851
Reduced:	FOC6H7 (2)
Stoich.:	ABC6D7 (2)
Weight, g/mol:	172.121178
ΔH_f, kcal/mol:	-176.64
Dipole, Da:	3.23
IP(EA), eV:	-9.54(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(pyrrolidin-3-ylamino)butanoic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)F)C(C2CCCO2)O

DOS

IR

Vibrations