Geometry & MOs

Info

ID:	351311
PubChem CID:	127280199
Reduced:	O2N7C16H27 (1)
Stoich.:	A2B7C16D27 (1)
Weight, g/mol:	392.278741
ΔH_f, kcal/mol:	-18.79
Dipole, Da:	9.69
IP(EA), eV:	-9.46(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1-acetylpiperidine-3-carbonyl)piperazin-1-yl]-N-cyclohexyl-N-methylacetamide

Drug info:

PubChemData

Smile

CN(C1CCCCC1)C(=O)CN2CCN(CC2)C(=O)CN3C=NN=N3

DOS

IR

Vibrations