Geometry & MOs

Info

ID:	405136
PubChem CID:	135072667
Reduced:	NO2C8H12 (2)
Stoich.:	AB2C8D12 (2)
Weight, g/mol:	309.181432
ΔH_f, kcal/mol:	-115.18
Dipole, Da:	2.24
IP(EA), eV:	-9.84(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(Z)-3-ethoxy-1-hydroxy-1-(2-methyldeca-3,4-dienoxy)-3-oxoprop-1-ene-2-diazonium

Drug info:

PubChemData

Smile

CCCCCC=C=CC(C)CO/C(=C(/C(=O)OCC)\[N+]#N)/[O-]

DOS

IR

Vibrations