Geometry & MOs

Info

ID:	295602
PubChem CID:	117537002
Reduced:	ON3C12H17 (1)
Stoich.:	AB3C12D17 (1)
Weight, g/mol:	213.220498
ΔH_f, kcal/mol:	23.47
Dipole, Da:	2.27
IP(EA), eV:	-9.14(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-methyl-N'-[1-(2-methylpropyl)piperidin-3-yl]ethane-1,2-diamine

Drug info:

PubChemData

Smile

CN(CC#N)C1CCN(C1)CC2=CC=CO2

DOS

IR

Vibrations