Geometry & MOs

Info

ID:	127039
PubChem CID:	50988328
Reduced:	Cl2N4C13H22 (1)
Stoich.:	A2B4C13D22 (1)
Weight, g/mol:	160.053404
ΔH_f, kcal/mol:	-18.99
Dipole, Da:	4.56
IP(EA), eV:	-9.15(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butane-1,2-diamine;dihydrochloride

Drug info:

PubChemData

Smile

CCC(C)CNCCC1=NN=C2N1C=CC=C2.Cl.Cl

DOS

IR

Vibrations