230
8 Models of Chemical Bonding and “Empirical” Methods
Allred AL, Rochow EG (1958) A scale of electronegativity based on electrostatic force. J Inorg
Nucl Chem 5:264–268
Alvarez S (2013) A cartography of the van der Waals territories. Dalton Trans 42:8617–8636
Bader RFW (1990) Atoms in molecules: a quantum theory. Oxford University Press, New York
Badger M (1935) The relation between the internuclear distances and force constants of molecules
and its application to polyatomic molecules. J Chem Phys 3:710–714
Bartell LS, Bonham RA (1960) Structure of isobutylene. J Chem Phys 32:824–826
Bernstein HJ (1962) The average XH stretching frequency as a measure of XH bond properties.
Spectrochim Acta 18:161–170
Birge RT, Spooner H (1926) The heat of dissociation of non-polar molecules. Phys Rev 28:259–283
Bratsch SG (1985) A group electronegativity method with Pauling units. J Chem Ed 62:101–103
Cioslowski J, Mixon ST (1991) Covalent bond orders in the topological theory of atoms in molecules.
J Am Chem Soc 113:4142–4145
Craig NC, Chen Y, Fuson HA, Tian H, van Besien H, Conrad AR, Tubergen MJ, Rudolph HD,
Demaison J (2013) Microwave spectra of the deuterium isotopologues of cis-hexatriene and a
semiexperimental equilibrium structure. J Phys Chem A 117:9391–9400
Cremer D, Larsson JA, Kraka E (1998) New developments in the analysis of vibrational spectra: on
the use of adiabatic internal, vibrational modes. In: Parkanyi C (ed) Theoretical and computational
chemistry, vol 5. Theoretical organic chemistry. Elsevier, Amsterdam, pp 259–328
Demaison J, Rudolph HD (2008) Ab initio anharmonic force field and equilibrium structure of
propene. J Mol Spectrosc 248:66–76
Demaison J, Margulès L, Boggs JE (2000) The equilibrium N-H. Chem Phys 260:65–81
Demaison J, Margulès L, Boggs JE (2003) The equilibrium C–Cl, C–Br, and C–I bond lengths from
ab initio calculations, microwave and infrared spectroscopies, and. Struct Chem 14:159–174
Demaison J, Craig NC, Cocinero EJ, Grabow J-U, Lesarri A, Rudolph HD (2012) Semiexperimental
equilibrium structures for the equatorial conformers of N-methylpiperidone and tropinone by the
mixed estimation method. J Phys Chem A 116:8684–8692
Demaison J, Herman M, Liévin J (2007) The equilibrium OH. Intern Rev Phys Chem 26:391–420
Demaison J, Vogt N, Saragi RT, Juanes M, Rudolph HD, Lesarri A (2019) The S–S bridge: a
mixed experimental-computational estimation of the equilibrium structure of diphenyl disulfide.
ChemPhysChem 20:366–373
Domenicano A (1992) Structural substituent effects in benzene derivatives. In: Domenicano A,
Hargittai I (eds) Accurate molecular structures: their determination and importance. Oxford
University Press, pp 437–468
Gillespie RJ, Hargittai I (1991) The VSEPR model of molecular geometry. Allyn and Bacon, Boston
Gillespie RJ, Nyholm RS (1957) Inorganic stereochemistry. Quart Rev Chem Soc 11:339–380
Gillespie RJ, Popelier PLA (2001) Chemical bonding and molecular geometry. Oxford University
Press, New York
Gillespie RJ, Robinson EA (1998) Molecular geometry of “ionic” molecules: a ligand close-packing
model. In: Hargittai M, Hargittai I (eds) Advances in molecular structure research, vol 4. JAI Press,
Stanford, pp 1–42
Hargittai I (1985) The structure of volatile sulphur compounds. Reidel, Dordrecht
Hargittai I, Levy JB (1999) Accessible geometrical changes. Struct Chem 10:387–389
Haasnoot CAG, DeLeeuw FAAM, Altona C (1980) The relationship between proton-proton NMR
coupling constants and substituent electronegativities—I: An empirical generalization of the.
Tetrahedron 36:2783–2792
Hayashi M, Adachi M (1982) Revised r s structures of three dialkyl ethers. J Mol Spectrosc 78:53–62
Henry BR (1981) The local mode model. In: Durig JR (ed) Vibrational spectra and structure, vol
10. Elsevier, New York, pp 269–319
Henry BR (1987) The local mode model and overtone spectra: a probe of molecular structure and
conformation. Acc Chem Res 20:429–435
Herschbach DR, Laurie VW (1961) Anharmonic potential constants and their dependence upon. J
Chem Phys 35:458–463
8 Models of Chemical Bonding and “Empirical” Methods
Allred AL, Rochow EG (1958) A scale of electronegativity based on electrostatic force. J Inorg
Nucl Chem 5:264–268
Alvarez S (2013) A cartography of the van der Waals territories. Dalton Trans 42:8617–8636
Bader RFW (1990) Atoms in molecules: a quantum theory. Oxford University Press, New York
Badger M (1935) The relation between the internuclear distances and force constants of molecules
and its application to polyatomic molecules. J Chem Phys 3:710–714
Bartell LS, Bonham RA (1960) Structure of isobutylene. J Chem Phys 32:824–826
Bernstein HJ (1962) The average XH stretching frequency as a measure of XH bond properties.
Spectrochim Acta 18:161–170
Birge RT, Spooner H (1926) The heat of dissociation of non-polar molecules. Phys Rev 28:259–283
Bratsch SG (1985) A group electronegativity method with Pauling units. J Chem Ed 62:101–103
Cioslowski J, Mixon ST (1991) Covalent bond orders in the topological theory of atoms in molecules.
J Am Chem Soc 113:4142–4145
Craig NC, Chen Y, Fuson HA, Tian H, van Besien H, Conrad AR, Tubergen MJ, Rudolph HD,
Demaison J (2013) Microwave spectra of the deuterium isotopologues of cis-hexatriene and a
semiexperimental equilibrium structure. J Phys Chem A 117:9391–9400
Cremer D, Larsson JA, Kraka E (1998) New developments in the analysis of vibrational spectra: on
the use of adiabatic internal, vibrational modes. In: Parkanyi C (ed) Theoretical and computational
chemistry, vol 5. Theoretical organic chemistry. Elsevier, Amsterdam, pp 259–328
Demaison J, Rudolph HD (2008) Ab initio anharmonic force field and equilibrium structure of
propene. J Mol Spectrosc 248:66–76
Demaison J, Margulès L, Boggs JE (2000) The equilibrium N-H. Chem Phys 260:65–81
Demaison J, Margulès L, Boggs JE (2003) The equilibrium C–Cl, C–Br, and C–I bond lengths from
ab initio calculations, microwave and infrared spectroscopies, and. Struct Chem 14:159–174
Demaison J, Craig NC, Cocinero EJ, Grabow J-U, Lesarri A, Rudolph HD (2012) Semiexperimental
equilibrium structures for the equatorial conformers of N-methylpiperidone and tropinone by the
mixed estimation method. J Phys Chem A 116:8684–8692
Demaison J, Herman M, Liévin J (2007) The equilibrium OH. Intern Rev Phys Chem 26:391–420
Demaison J, Vogt N, Saragi RT, Juanes M, Rudolph HD, Lesarri A (2019) The S–S bridge: a
mixed experimental-computational estimation of the equilibrium structure of diphenyl disulfide.
ChemPhysChem 20:366–373
Domenicano A (1992) Structural substituent effects in benzene derivatives. In: Domenicano A,
Hargittai I (eds) Accurate molecular structures: their determination and importance. Oxford
University Press, pp 437–468
Gillespie RJ, Hargittai I (1991) The VSEPR model of molecular geometry. Allyn and Bacon, Boston
Gillespie RJ, Nyholm RS (1957) Inorganic stereochemistry. Quart Rev Chem Soc 11:339–380
Gillespie RJ, Popelier PLA (2001) Chemical bonding and molecular geometry. Oxford University
Press, New York
Gillespie RJ, Robinson EA (1998) Molecular geometry of “ionic” molecules: a ligand close-packing
model. In: Hargittai M, Hargittai I (eds) Advances in molecular structure research, vol 4. JAI Press,
Stanford, pp 1–42
Hargittai I (1985) The structure of volatile sulphur compounds. Reidel, Dordrecht
Hargittai I, Levy JB (1999) Accessible geometrical changes. Struct Chem 10:387–389
Haasnoot CAG, DeLeeuw FAAM, Altona C (1980) The relationship between proton-proton NMR
coupling constants and substituent electronegativities—I: An empirical generalization of the.
Tetrahedron 36:2783–2792
Hayashi M, Adachi M (1982) Revised r s structures of three dialkyl ethers. J Mol Spectrosc 78:53–62
Henry BR (1981) The local mode model. In: Durig JR (ed) Vibrational spectra and structure, vol
10. Elsevier, New York, pp 269–319
Henry BR (1987) The local mode model and overtone spectra: a probe of molecular structure and
conformation. Acc Chem Res 20:429–435
Herschbach DR, Laurie VW (1961) Anharmonic potential constants and their dependence upon. J
Chem Phys 35:458–463