Geometry & MOs

Info

ID:	357786
PubChem CID:	127294573
Reduced:	O2F3N4C19H21 (1)
Stoich.:	A2B3C4D19E21 (1)
Weight, g/mol:	210.136828
ΔH_f, kcal/mol:	-145.15
Dipole, Da:	6.15
IP(EA), eV:	-9.07(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-acetyl-N-cyclobutylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCN(C1)C2CCCN(C2)C(=O)C3=CC=C(C=C3)C4=NOC(=N4)C(F)(F)F

DOS

IR

Vibrations