Geometry & MOs

Info

ID:	370357
PubChem CID:	127338220
Reduced:	O2N3C15H27 (1)
Stoich.:	A2B3C15D27 (1)
Weight, g/mol:	281.210327
ΔH_f, kcal/mol:	-111.79
Dipole, Da:	6.86
IP(EA), eV:	-8.81(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-acetylpiperazin-1-yl)-1-(2,6-dimethylpiperidin-1-yl)ethanone

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCCCC1)N2CCN(CC2)C(=O)C

DOS

IR

Vibrations