Geometry & MOs

Info

ID:	260418
PubChem CID:	103190607
Reduced:	ClN3C16H28 (1)
Stoich.:	AB3C16D28 (1)
Weight, g/mol:	236.165541
ΔH_f, kcal/mol:	-15.67
Dipole, Da:	3.32
IP(EA), eV:	-8.11(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-[2-(2-chloroethoxy)ethyl]-2-N-ethyl-1-N,1-N-dimethylpropane-1,2-diamine

Drug info:

PubChemData

Smile

CCCC1=NC(=CC(=C1)CCl)N(CC)C(C)CN(C)C

DOS

IR

Vibrations