Geometry & MOs

Info

ID:	206559
PubChem CID:	80267923
Reduced:	N3C17H29 (1)
Stoich.:	A3B17C29 (1)
Weight, g/mol:	251.095771
ΔH_f, kcal/mol:	-3.99
Dipole, Da:	1.32
IP(EA), eV:	-8.65(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-fluoro-4-methylbenzoyl)pyrrolidine-3-carboxylic acid

Drug info:

PubChemData

Smile

CCCNC1CCCCC1N(C)CC2=CC=CC(=N2)C

DOS

IR

Vibrations