Geometry & MOs

Info

ID:	163472
PubChem CID:	57998787
Reduced:	NO2C20H25 (1)
Stoich.:	AB2C20D25 (1)
Weight, g/mol:	145.090292
ΔH_f, kcal/mol:	-47.07
Dipole, Da:	4.56
IP(EA), eV:	-8.84(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3R)-3-fluoropyrrolidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CCC1=C(C(=CC(=C1)C2CC2)C)C3=C(C(NC3=O)(C)C4CC4)O

DOS

IR

Vibrations