Geometry & MOs

Info

ID:	359524
PubChem CID:	127298798
Reduced:	ON6C17H28 (1)
Stoich.:	AB6C17D28 (1)
Weight, g/mol:	239.199762
ΔH_f, kcal/mol:	-4.05
Dipole, Da:	1.93
IP(EA), eV:	-8.65(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dimethylpiperazin-1-yl)-1-piperidin-1-ylethanone

Drug info:

PubChemData

Smile

CC1CN(CCN1CCC(=O)N2CCN(CC2)C3=NC=CC=N3)C

DOS

IR

Vibrations