Geometry & MOs

Info

ID:	276216
PubChem CID:	103821297
Reduced:	ClSO3N4H11C12 (1)
Stoich.:	ABC3D4E11F12 (1)
Weight, g/mol:	214.204513
ΔH_f, kcal/mol:	13.83
Dipole, Da:	4.34
IP(EA), eV:	-9.41(-2.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-methoxypentyl)-2-methylpiperidin-4-amine

Drug info:

PubChemData

Smile

CC(C)C1=CSC(=N1)NC(=O)C2=C(N=CC(=C2)[N+](=O)[O-])Cl

DOS

IR

Vibrations