Geometry & MOs

Info

ID:	252184
PubChem CID:	103109664
Reduced:	ON2C12H28 (1)
Stoich.:	AB2C12D28 (1)
Weight, g/mol:	246.095747
ΔH_f, kcal/mol:	-71.94
Dipole, Da:	3.71
IP(EA), eV:	-8.46(2.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-[(3-chlorothiophen-2-yl)methyl]-1-N-ethyl-1-N-methylpropane-1,2-diamine

Drug info:

PubChemData

Smile

CCN(C)CC(C)NCCCCOCC

DOS

IR

Vibrations