Geometry & MOs

Info

ID:	356832
PubChem CID:	127292372
Reduced:	ON5C17H29 (1)
Stoich.:	AB5C17D29 (1)
Weight, g/mol:	282.205576
ΔH_f, kcal/mol:	-38.97
Dipole, Da:	2.92
IP(EA), eV:	-8.72(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-oxo-N-[(1-propylpyrrolidin-3-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCCN1CCC(C1)CNC(=O)N2CCCCC2C3=NC=CN3

DOS

IR

Vibrations