Geometry & MOs

Info

ID:	151612
PubChem CID:	55161673
Reduced:	ClON3C13H18 (1)
Stoich.:	ABC3D13E18 (1)
Weight, g/mol:	240.195011
ΔH_f, kcal/mol:	-19.31
Dipole, Da:	3.87
IP(EA), eV:	-9.02(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-(2-pyrrolidin-1-ylethyl)piperazine-2-carboxamide

Drug info:

PubChemData

Smile

CN(CCN1CCCC1)C(=O)C2=CN=C(C=C2)Cl

DOS

IR

Vibrations