Geometry & MOs

Info

ID:	129844
PubChem CID:	51074027
Reduced:	NC7H12 (2)
Stoich.:	AB7C12 (2)
Weight, g/mol:	289.179027
ΔH_f, kcal/mol:	-9.78
Dipole, Da:	4.17
IP(EA), eV:	-8.71(1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[1-(2,5-dimethylphenyl)ethylamino]acetyl]piperazin-2-one

Drug info:

PubChemData

Smile

C1CCC2C(C1)CCCN2CCCCC#N

DOS

IR

Vibrations