Geometry & MOs

Info

ID:	405265
PubChem CID:	135073303
Reduced:	NO2C14H23 (1)
Stoich.:	AB2C14D23 (1)
Weight, g/mol:	284.077262
ΔH_f, kcal/mol:	-76.93
Dipole, Da:	3.74
IP(EA), eV:	-9.58(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-2-diazonio-1-(2-methylprop-2-enoxy)-2-[3-(trifluoromethyl)phenyl]ethenolate

Drug info:

PubChemData

Smile

CCCC(=NC(C)CCC(=O)OCC)C#CC

DOS

IR

Vibrations