Geometry & MOs

Info

ID:	64699
PubChem CID:	29203872
Reduced:	FOCl2N4H21C22 (1)
Stoich.:	ABC2D4E21F22 (1)
Weight, g/mol:	362.220557
ΔH_f, kcal/mol:	-10.97
Dipole, Da:	6.06
IP(EA), eV:	-8.46(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-(3-butoxypropyl)-1-(2-ethoxyphenyl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1C(=O)N2CCN(CC2)C3=CC=CC=C3F)Cl)CC4=CC=CC=C4Cl

DOS

IR

Vibrations