Geometry & MOs

Info

ID:	260160
PubChem CID:	103183525
Reduced:	NO2C17H35 (1)
Stoich.:	AB2C17D35 (1)
Weight, g/mol:	242.108899
ΔH_f, kcal/mol:	-112.62
Dipole, Da:	3.27
IP(EA), eV:	-8.81(2.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethyl-2-(propan-2-ylsulfonylmethyl)pyridin-4-amine

Drug info:

PubChemData

Smile

CCCCC(CC)(CCOCCCOC)CNC1CC1

DOS

IR

Vibrations