Geometry & MOs

Info

ID:	380275
PubChem CID:	134970677
Reduced:	N2O2C9H14 (1)
Stoich.:	A2B2C9D14 (1)
Weight, g/mol:	183.113353
ΔH_f, kcal/mol:	-37.17
Dipole, Da:	1.1
IP(EA), eV:	-9.62(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(Z)-1-[(Z)-hex-2-enoxy]-1-hydroxyprop-1-ene-2-diazonium

Drug info:

PubChemData

Smile

CCC/C=C\CO/C(=C(/C)\[N+]#N)/[O-]

DOS

IR

Vibrations