Geometry & MOs

Info

ID:	279067
PubChem CID:	103840884
Reduced:	NO2C6H7 (2)
Stoich.:	AB2C6D7 (2)
Weight, g/mol:	213.220498
ΔH_f, kcal/mol:	-153.53
Dipole, Da:	4.26
IP(EA), eV:	-9.66(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-ethyl-N,N-dimethyl-N'-(piperidin-3-ylmethyl)ethane-1,2-diamine

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2=CC=CC(=O)N2)C(=O)O

DOS

IR

Vibrations