Geometry & MOs

Info

ID:	10884
PubChem CID:	108674
Reduced:	NCl3C8H18 (1)
Stoich.:	AB3C8D18 (1)
Weight, g/mol:	233.050483
ΔH_f, kcal/mol:	-74.93
Dipole, Da:	5.14
IP(EA), eV:	-9.12(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-bis(2-chloroethyl)butan-1-amine;hydrochloride

Drug info:

PubChemData

Smile

CCCCN(CCCl)CCCl.Cl

DOS

IR

Vibrations