Geometry & MOs

Info

ID:	209615
PubChem CID:	80694760
Reduced:	ClFNO2H7C10 (1)
Stoich.:	ABCD2E7F10 (1)
Weight, g/mol:	189.116507
ΔH_f, kcal/mol:	-91.12
Dipole, Da:	4.21
IP(EA), eV:	-9.31(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-1-(2-fluoroethyl)pyrrolidine-3-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1Cl)C(=O)C(=O)N2CCF

DOS

IR

Vibrations