Geometry & MOs

Info

ID:	159393
PubChem CID:	57269800
Reduced:	ClSO4N8C19H25 (1)
Stoich.:	ABC4D8E19F25 (1)
Weight, g/mol:	340.38175
ΔH_f, kcal/mol:	-65.22
Dipole, Da:	3.97
IP(EA), eV:	-8.45(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N'-bis(2-ethylhexyl)hexane-1,6-diamine

Drug info:

PubChemData

Smile

CN1C=CN=C1SC2CCN(CC2)NC3=C4C(=NC(=N3)Cl)N(C=N4)[C@H]5C(C([C@H](O5)CO)O)O

DOS

IR

Vibrations