Geometry & MOs

Info

ID:	413759
PubChem CID:	135086709
Reduced:	N3O4C16H21 (1)
Stoich.:	A3B4C16D21 (1)
Weight, g/mol:	320.161031
ΔH_f, kcal/mol:	-123.85
Dipole, Da:	1.83
IP(EA), eV:	-9.62(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations