Geometry & MOs

Info

ID:	191890
PubChem CID:	78197918
Reduced:	N6O6C21H44 (1)
Stoich.:	A6B6C21D44 (1)
Weight, g/mol:	504.363533
ΔH_f, kcal/mol:	-306.39
Dipole, Da:	6.78
IP(EA), eV:	-8.85(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-amino-2-[[6-amino-2-[[2-(7-aminoheptylamino)acetyl]amino]hexoxy]carbonylamino]hexyl] hydrogen carbonate

Drug info:

PubChemData

Smile

C(CCN)CCNCC(=O)NC(CCCCN)COC(=O)NC(CCCCN)COC(=O)O

DOS

IR

Vibrations