Geometry & MOs

Info

ID:	405143
PubChem CID:	135072777
Reduced:	PO4C19H23 (1)
Stoich.:	AB4C19D23 (1)
Weight, g/mol:	336.087685
ΔH_f, kcal/mol:	-191.9
Dipole, Da:	0.78
IP(EA), eV:	-9.19(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-6-(4-chlorophenyl)-2-diazonio-1-[(2-methylpropan-2-yl)oxy]-1,6-dioxohex-2-en-3-olate

Drug info:

PubChemData

Smile

CCOP(=O)(OCC)OCC=C(C1=CC=CC=C1)C2=CC=CC=C2

DOS

IR

Vibrations