Geometry & MOs

Info

ID:	347671
PubChem CID:	127272537
Reduced:	SN2O3C17H30 (1)
Stoich.:	AB2C3D17E30 (1)
Weight, g/mol:	253.215413
ΔH_f, kcal/mol:	-154.12
Dipole, Da:	9.57
IP(EA), eV:	-8.7(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dimethylpiperidin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone

Drug info:

PubChemData

Smile

C1CCCN(CC1)CC(=O)N(C2CCCC2)C3CCS(=O)(=O)C3

DOS

IR

Vibrations