Geometry & MOs

Info

ID:	212048
PubChem CID:	81059307
Reduced:	SN2O3C12H20 (1)
Stoich.:	AB2C3D12E20 (1)
Weight, g/mol:	271.262363
ΔH_f, kcal/mol:	-95.33
Dipole, Da:	5.74
IP(EA), eV:	-9.39(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(aminomethyl)-N-methyl-1-propan-2-yl-N-(2-propan-2-yloxyethyl)piperidin-4-amine

Drug info:

PubChemData

Smile

CCOCCN(C)S(=O)(=O)C1=CC=CC(=C1)CN

DOS

IR

Vibrations