Geometry & MOs

Info

ID:	259992
PubChem CID:	103179025
Reduced:	SN2O4C11H26 (1)
Stoich.:	AB2C4D11E26 (1)
Weight, g/mol:	259.225977
ΔH_f, kcal/mol:	-192.67
Dipole, Da:	4.58
IP(EA), eV:	-9.02(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-(3-methoxypropoxy)ethanamine

Drug info:

PubChemData

Smile

CC(C)(CNCCOCCCOC)NS(=O)(=O)C

DOS

IR

Vibrations