Geometry & MOs

Info

ID:	139855
PubChem CID:	52608819
Reduced:	O3N4C20H36 (1)
Stoich.:	A3B4C20D36 (1)
Weight, g/mol:	385.197712
ΔH_f, kcal/mol:	-161.66
Dipole, Da:	5.63
IP(EA), eV:	-8.69(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1-(2-ethylphenyl)-N-[3-[methyl(2,2,2-trifluoroethyl)amino]propyl]-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C[C@@H]1CN(C[C@@H](O1)C)CCCNC(=O)C2CCN(CC2)C(=O)N3CCCC3

DOS

IR

Vibrations