Geometry & MOs

Info

ID:	178354
PubChem CID:	76314694
Reduced:	NC4H8 (6)
Stoich.:	AB4C8 (6)
Weight, g/mol:	627.544271
ΔH_f, kcal/mol:	-12.66
Dipole, Da:	3.13
IP(EA), eV:	-8.97(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[4-[[3,5-bis[[4-(4-aminobutylamino)butylamino]methyl]phenyl]methylamino]butyl]butane-1,4-diamine;hydrochloride

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)CNCCCCNCCCCN)CNCCCCNCCCCN

DOS

IR

Vibrations