Geometry & MOs

Info

ID:	221374
PubChem CID:	85272324
Reduced:	PO4C10H17 (1)
Stoich.:	AB4C10D17 (1)
Weight, g/mol:	232.084792
ΔH_f, kcal/mol:	-208.47
Dipole, Da:	7.28
IP(EA), eV:	-10.02(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-acetyloxy-1-diazonio-4-phenylbut-1-en-2-olate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations