Geometry & MOs

Info

ID:	284883
PubChem CID:	104080421
Reduced:	SN4C10H20 (1)
Stoich.:	AB4C10D20 (1)
Weight, g/mol:	247.204848
ΔH_f, kcal/mol:	28.93
Dipole, Da:	6.54
IP(EA), eV:	-8.7(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-methylpiperidin-4-yl)-N-[(3-methylpyridin-2-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CCSCCCNC(C)C1=NN=CN1C

DOS

IR

Vibrations