Geometry & MOs

Info

ID:	309420
PubChem CID:	126546157
Reduced:	OC12H16 (1)
Stoich.:	AB12C16 (1)
Weight, g/mol:	311.166748
ΔH_f, kcal/mol:	-38.35
Dipole, Da:	2.69
IP(EA), eV:	-9.33(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-tert-butyl-N-(1-methylsulfonylpiperidin-4-yl)pyridin-3-amine

Drug info:

PubChemData

Smile

CCC1=CC(=CC=C1)C2CCOC2

DOS

IR

Vibrations