Geometry & MOs

Info

ID:	441296
PubChem CID:	135233998
Reduced:	SN4O6C12H22 (1)
Stoich.:	AB4C6D12E22 (1)
Weight, g/mol:	272.257612
ΔH_f, kcal/mol:	-235.63
Dipole, Da:	9.2
IP(EA), eV:	-9.35(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[6-[amino-[(3R)-hexan-3-yl]amino]hexyl]acetamide

Drug info:

PubChemData

Smile

C1CC(N(C(=O)NC1)OS(=O)(=O)O)CC(=O)NC2CCNCC2

DOS

IR

Vibrations