Geometry & MOs

Info

ID:	137918
PubChem CID:	52283945
Reduced:	FO2N3C21H28 (1)
Stoich.:	AB2C3D21E28 (1)
Weight, g/mol:	373.216555
ΔH_f, kcal/mol:	-143.25
Dipole, Da:	5.42
IP(EA), eV:	-8.49(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-cyclohexyl-N-[2-fluoro-5-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)[C@H]2CCCN2C(=O)NC3=C(C=CC(=C3)N4CCCC4=O)F

DOS

IR

Vibrations