Energy bond breaking, estimating

To estimate the amount of energy absorbed or released in this reaction, we must compile an inventoiy of all the bonds that break and all the bonds that form. A ball-and-stick model shows that propane contains 8 C—H bonds and 2 C—C bonds. These bonds break in each propane molecule, and one ODO bond breaks in each oxygen molecule. Two CDO bonds form in each CO2 molecule, and two O—H bonds form in each H2 O molecule. In summary ... 

BWG and anti-phase boundary energies. The bond-breaking method first described by Flinn (I960) allows an estimate to be made for the structural component of anti-phase boundary (APB) energies. As good agreement can be obtained... 

The +C(SH)3 cation and the radical dication derived from it have been the subject of high-level calculations.67 The ability of two adjacent sulfur atoms to stabilize cations, anions, and radicals makes these species usefiil for relating bond-breaking and electron-transfer energies.68,69 Electrophilicity parameters for the dithiocarbenium ions (27) have been worked out,70 and the stabilities of the cations (28), (29) and (30) have been estimated using PM3 calculations.71 Cation (31) can be captured by solvent or azide ion, or it may ring close to (32), which subsequently alkylates another (31) cation as shown.72... 

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