Geometry & MOs

Info

ID:	351540
PubChem CID:	127280428
Reduced:	O4N5C16H23 (1)
Stoich.:	A4B5C16D23 (1)
Weight, g/mol:	390.187875
ΔH_f, kcal/mol:	-162.33
Dipole, Da:	6.54
IP(EA), eV:	-9.12(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(2-pyrrolidin-1-ylacetyl)piperazine-1-carbonyl]-1-(2,2,2-trifluoroethyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CN1C=C(C(=O)NC1=O)C(=O)N2CCN(CC2)C(=O)CN3CCCC3

DOS

IR

Vibrations