Geometry & MOs

Info

ID:	139221
PubChem CID:	52493615
Reduced:	SN2O4C17H24 (1)
Stoich.:	AB2C4D17E24 (1)
Weight, g/mol:	259.225977
ΔH_f, kcal/mol:	-134.28
Dipole, Da:	3.78
IP(EA), eV:	-8.9(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

[4-(azaniumylmethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]-dimethylazanium

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=C)C

DOS

IR

Vibrations