Geometry & MOs

Info

ID:	367953
PubChem CID:	127326136
Reduced:	ON2C10H18 (2)
Stoich.:	AB2C10D18 (2)
Weight, g/mol:	398.268176
ΔH_f, kcal/mol:	-123.94
Dipole, Da:	3.96
IP(EA), eV:	-8.55(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(4-methylcyclohexyl)piperazin-1-yl]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)N2CCN(CC2)C(C)C(=O)N3CCCC(C3)C(=O)N

DOS

IR

Vibrations