Geometry & MOs

Info

ID:	413761
PubChem CID:	135086711
Reduced:	N3O4C17H23 (1)
Stoich.:	A3B4C17D23 (1)
Weight, g/mol:	334.176681
ΔH_f, kcal/mol:	-134.07
Dipole, Da:	2.34
IP(EA), eV:	-9.4(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(Z)-1-ethoxy-1-hydroxy-3-(4-methylphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]prop-1-ene-2-diazonium

Drug info:

PubChemData

Smile

CCO/C(=C(/C(C1=CC=C(C=C1)C)NC(=O)OC(C)(C)C)\[N+]#N)/[O-]

DOS

IR

Vibrations