Geometry & MOs

Info

ID:	129151
PubChem CID:	51071716
Reduced:	N3O3C19H27 (1)
Stoich.:	A3B3C19D27 (1)
Weight, g/mol:	389.21147
ΔH_f, kcal/mol:	-130.55
Dipole, Da:	5.2
IP(EA), eV:	-9.64(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-(cyclopentanecarbonyl)-N-[3-[(4-fluorobenzoyl)amino]propyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCCC(=O)N1CCC[C@H]1C(=O)NCCCNC(=O)C2=CC=CC=C2

DOS

IR

Vibrations