Abstract
In the current review of the journal Structural Chemistry, the content of the issues 4–6 for the calendar year 2011 is related to thermochemistry. To the summary of each paper, a brief thermochemical commentary is added.
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Abbreviations
- 1D:
-
One-dimensional
- 2D:
-
Two-dimensional
- 3D:
-
Three-dimensional
- AIM:
-
Atoms in molecules
- DFT:
-
Density functional theory
- EDA:
-
Energy decomposition analysis
- MD:
-
Molecular dynamics
- MO:
-
Molecular orbital
- NBO:
-
Natural bond orbital
- QSAR:
-
Quantitative structure–activity relationship
- QSPR:
-
Quantitative structure–property relationship
References
For 2001: Liebman JF (2003) Struct Chem 14:403
For 2002: Stem-Beren MR, Liebman JF (2005) Struct Chem 16:159
For 2003: Stem MR, Liebman JF (2005) Struct Chem 16:593
For 2004: Stem MR, Liebman JF (2006) Struct Chem 17:3
For 2005: Ponikvar-Svet M, Keating LR, Dodson BJ, Liebman JF (2010) Struct Chem 21:527
For 2006: Ponikvar-Svet M, Liebman JF (2009) Struct Chem 20:1019
For 2007: Ponikvar M, Liebman JF (2008) Struct Chem 19:849
For 2008: Ponikvar-Svet M, Keating LR, Dodson BJ, Liebman JF (2009) Struct Chem 20:719
For 2009: Ponikvar-Svet M, Liebman JF (2010) Struct Chem 21:1131
For 2010: Ponikvar-Svet M, Liebman JF (2011) Struct Chem 22:717
For issue 1–3 of 2011 volume: Ponikvar-Svet M, Liebman JF (2011) Struct Chem 22:1179
Wagman DD, Evans WH, Parker VB, Schumm RH, Halow I, Bailey SM, Churney KL, Nuttall RL (1982) The NBS tables of chemical thermodynamic properties: Selected values for inorganic and C1 and C2 organic substances in SI units. J Phys Chem Ref Data 11(Suppl 2):1
Pedley JB (1994) Thermochemical data and structures of organic compounds, vol 1. TRC Data Series, College Station, Texas
Hargittai I (2011) Struct Chem 22:745
Gao LX, Gan LH, An J, Pan FS (2011) Struct Chem 22:749
Papina TS, Luk’yanova VA, Goryunkov AA, Ioffe IN, Gol’dt IV, Buyanovskaya AG, Kabaeva NM, Sidorov LN (2007) Russ J Phys Chem A 81:1560
Dorozhko PA, Popov AA, Korobov MV, Tumanskii BL (1998) Chem Phys Lett 287:154
Junming L, Yunxiang L, Subin Y, Weiliang Z (2011) Struct Chem 22:757
Berthelot (1900) C R Hebd Acad Sci 130:441
Benson SW (1978) Chem Rev 78:23
Machura B, Wolff M, Świtlicka A, Gryca I, Nawrot I, Kruszynski R (2011) Struct Chem 22:765
Ghule VD, Radhakrishnan S, Jadhav PM (2011) Struct Chem 22:775
Lebedev VP, Matyushin YN, Miroshnichenko EA, Konkova TS, Vorobev AB, Inozemtsev YO (2008) Intl Ann Conf ICT 39(47):1
Matushin YN, Lebedev YP, 28 Intl Ann Conf ICT (1997), (Combustion and Detonation), 98.1
Li P, Zhai Y, Wang W, Ma Z, Bi S, Sun H (2011) Struct Chem 22:783
Collatz H (1936) Cellul Chem 17:128
Zioudrou C, Stassinopoulou CI, Loukas S (1980) Bioorg Chem 9:163
Puzyn T, Mostrag-Szlichtyng A, Gajewicz A, Skrzyński M, Worth AP (2011) Struct Chem 22:795
Notario R, Roux MV, Liebman JF (2011) (unpublished results)
Karachi N, Boshra A, Jadidi S (2011) Struct Chem 22:805
Wu HS, Jiao H (2004) Chem Phys Lett 386:369
Wang JM, Guo JC (2011) Struct Chem 22:811
Michel R, Herbst-Irmer R, Stalke D (2011) Organometallics 30:4379
Minkin VI, Minyaev RM, Starikov AG, Gribanova TN (2005) Russ J Org Chem 41:1289
Perez-Peralta N, Contreras M, Tiznado W, Stewart J, Donald KJ, Merino G (2011) Phys Chem Chem Phys 13:12975
Vahedpour M, Goodarzi M, Hajari N, Nazari F (2011) Struct Chem 22:817
Yang X, Castleman AV Jr (1991) J Phys Chem 95:6182
Chakraborty A, Giri S, Chattaraj PK (2011) Struct Chem 22:823
Rakrai W, Morakot N, Keawwangchai S, Kaewtong C, Wanno B, Ruangpornvisuti V (2011) Struct Chem 22:839
Sas TM, Suvorov VV, Efremov VA, Rudnev VV, Chukurov PM (1984) Zh Obshch Kim 54:587
Shutalev AD, Savinkina EV, Albov DV, Zamilatskov IA, Buravlev EA (2011) Struct Chem 22:849
Roux MV, Temprado M, Jiménez P, Notario R, Parameswar AR, Demchenko AV, Chickos JS, Deakyne CA, Liebman JF (2011) J Chem Eng Data 56:4725
Ribeiro da Silva MdDMC, Ribeiro da Silva MAV, Freitas VLS, Roux MV, Jiménez P, Temprado Ml, Dávalos JZ, Cabildo P, Claramunt RM, Elguero J (2008) J Chem Thermodyn 40:386
Lu X, Shi L, Lian Z, Li Y (2011) Struct Chem 22:857
Solimannejad M, Nassirinia N, Amani S (2011) Struct Chem 22:865
Kirby AJ, Davies JE, Fox DJ, Hodgson DRW, Goeta AE, Lima MF, Priebe JP, Santaballa JA, Nome F (2010) Chem Commun 46:1302
Puzyn T, Gajewicz A, Rybacka A, Haranczyk M (2011) Struct Chem 22:873
Soares CS, da Silva CO (2011) Struct Chem 22:885
Pakhira S, Bera NC, Das AK (2011) Struct Chem 22:893
Buchachenko AA, Tscherbul TV, Klos J, Szczesniak MM, Chalasinski G, Webb R, Viehland LA (2005) J Chem Phys 122:194311/1
Schröder D, Harvey JN, Aschi M, Schwarz H (1998) J Chem Phys 108:8446
Klapötke TM (1997) Heteroatom Chem 8:473
Zhu H, Zhang J, Wen Z, Liu Y (2011) Struct Chem 22:901
Vriens GN, Hill AG (1952) Ind Eng Chem 44:2732
Tolosa Arroyo S, Hidalgo García A, Moreno Alvero M, Sansón Martín JA (2011) Struct Chem 22:909
Hall HK Jr, Baldt JH (1971) J Am Chem Soc 93:140
Hine J, Klueppet AW (1974) J Am Chem Soc 96:2924
Guthrie JP (1974) J Am Chem Soc 96:3608
Gladii SL, Starchevskii MK, Pazderskii YA, Moiseev II (1990) J Appl Chem USSR 63:106
Qi Y, Geng B, Chen Z (2011) Struct Chem 22:917
Kishikawa K, Tokitoh N, Okazaki R (1998) Chem Lett 239
Sengul A, Kurt O, Buyukgungor O (2011) Struct Chem 22:925
Singh UP, Kashyap S, Butcher RJ, Singh HJ, Mishra BK (2011) Struct Chem 22:931
Finch A, Gardner PJ, Hussain KS, Melaugh RA (1975) J Chem Thermodyn 7:881
Fan J, Tan JB, Shi QY, Zheng SR, Zhang WG (2011) Struct Chem 22:943
Gromova TI, Rudakova SV (1993) Zhur FK 67:1554
Matos MAR, Sousa CCS, Morais VMF (2008) J Chem Thermodyn 40:1485
Meng F, Wang H, Xu W (2011) Struct Chem 22:951
Diogo HP, Dias AR, Dhalla A, Minas da Piedade ME, Begley TP (1991) J Org Chem 56:7340
Hargittai B (2011) Struct Chem 22:957
Hargittai I, Hargittai B (2011) Struct Chem 22:961
Qu X, Xu L, Yang Y, Li F, Guo W (2011) Struct Chem 22:965
Serijan KT, Wise PH (1951) J Am Chem Soc 73:4766
Salcedo R, Fomina L (2011) Struct Chem 22:971
Kitagawa T, Lee Y, Hanamura M, Sakamoto H, Konno H, Takeuchi K, Komatsu K (2002) Chem Commun 3062
Alajarin M, Orenes RA, Pastor A (2011) Struct Chem 22:977
Emel’yanenko VN, Kabo GJ, Verevkin SP (2006) J Chem Eng Data 51:79
Ribeiro da Silva MDMC, Ribeiro da Silva MAV, Freitas VLS, Roux MV, Jiménez P, Dávalos JZ, Cabildo P, Claramunt RM, Pinilla E, Rosario Torres M, Elguero J (2010) J Chem Thermodyn 42:536
Yang MY, Yang HQ, Gao C, Qin S, Hu CW (2011) Struct Chem 22:983
Jacob KT, Uda T, Okabe TH, Waseda Y (2000) High Temp Mater Processes 19:11
Jacob KT, Prusty D (2010) J Alloys Compd 507:L17
Lopes Jesus AJ, Redinha JS (2011) Struct Chem 22:999
Geissman TA, Wilson BD, Medz RB (1954) J Am Chem Soc 76:4182
Drefahl G, Zimmermann H, Gehrke K (1960) Chem Ber 93:509
Guha S, Ray S, Chaudhury P (2011) Struct Chem 22:1007
Satoh T, Ito H, Ichihara T, Sakae H, Katakuse I (2003) J Mass Spectrom Soc Japn 51:391
Brown ID, Datars WR, Gillespie RJ, Morgan KR, Tun Z, Ummat PK (1985) J Sol Stat Chem 57:34
Kaur D, Sharma R, Aulakh D (2011) Struct Chem 22:1015
Deakyne CA, Ludden AK, Roux MV, Notario R, Demchenko AV, Chickos JS, Liebman JF (2010) J Phys Chem B 114:16253
Tan X, Li P, Wang W, Liu S, Wang F, Wang H (2011) Struct Chem 22:1031
Guo JH, Zhang H (2011) Struct Chem 22:1039
Gregusova A, Varga S, Černušak I, Noga J (2002) J Phys Chem B 16:10523
Gregusova A, Černušak I, Malkina O, Noga J (2003) Phys Chem Chem Phys 5:4084
Balabin RM (2011) Struct Chem 22:1047
Koizumi H, Baer T (2004) J Phys Chem A 108:5956
Machura B, Wolff M, Palion J, Świtlicka A, Nawrot I, Michalik K (2011) Struct Chem 22:1053
Al-Ajlouni AM, Guenyar A, Zhou M-D, Baxter PNW, Kühn FE (2009) Eur J Inorg Chem 1019
Varga Z, Hargittai M, Bartell LS (2011) Struct Chem 22:1065
Wang F, Du HC, Zhang JY, Gong XD (2011) Struct Chem 22:1067
Biesemeier F, Mueller U (2004) Zeit Naturforsch B 59:351
Deuri S, Phukan P (2011) Struct Chem 22:1075
Petrov AA (1950) Dokl Akad Nauk SSSR 72:515
Alkorta I, Élguero J (2011) Struct Chem 22:1087
Liu Y, Linder PE, Lemal DM (1999) J Am Chem Soc 121:10626
Centore R, Carella A, Fusco S (2011) Struct Chem 22:1095
Zhang Y, Guo Y, Joo Y-H, Parrish DA, Shreeve JM (2010) Chem Eur J 16:10778
Klapötke TM, Martin FA, Mayr NT, Stierstorfer J (2010) Zeit Anorg Allg Chem 636:2555
Sreevidya TV, Golden G, Saper N, Feldman J, Botoshansky M, Kaftory M (2011) Struct Chem 22:1105
Beak P, Woods TS, Mueller DS (1972) Tetrahedron 28:5507
Karabaev AS, Nadirova DA, Ismailov TS, Razikov KK (1984) Probl Kalorim Khim Termodin Dokl Vses Konf 10th (ed Emanuel IM) 1:237
Shi Q, Tan ZC, Di YY, Tong B, Wang SX, Li YS (2007) Thermochim Acta 463:6
Acree WE Jr, Tucker SA, Ribeiro da Silva MDM, Matos MAR, Goncalves JM, Ribeiro da Silva MA, Pilcher GJ (1995) Chem Thermodyn 27:391
Ribeiro da Silva MDMC, Matos MAR, Vaz MC, Santos LMNBF, Pilcher G, Acree WE Jr, Powell JR (1998) J Chem Thermodyn 30:869
Ran J, Tong YP (2011) Struct Chem 22:1113
Bordwell FG, Li GZ (1992) J Org Chem 57:3019
Liu J, Wang F, Li Z, Zhou J, Chen J, Xia C (2011) Struct Chem 22:1119
Perisanu S, Contineanu I, Neacsu A, Tanasescu S (2010) J Therm Anal Calorim 101:1127
Roux MV, Smith PJ, Liebman JF (2005) Struct Chem 16:73
Campanelli AR, Domenicano A, Macchiagodena M, Ramondo F (2011) Struct Chem 22:1131
Ośmiałowski B, Kolehmainen E, Kalenius E, Behera B, Kauppinen R, Sievänen E (2011) Struct Chem 22:1143
Ribeiro da Silva MAV, Matos MAR, Morais VMF (1995) J Chem Soc Faraday Trans 91:1907
Sabbah R, Tabet D, Ermelinda SEM (1998) Thermochim Acta 315:93
Alizadeh R, Amani V (2011) Struct Chem 22:1153
Ribeiro da Silva MAV, Matos MAR, do Rio CMA, Morais VMF (1997) J Chem Soc Faraday Trans 93:3061
Tavakol H (2011) Struct Chem 22:1165
Karyakin NV, Sapozhnikov VN, Kiparisova EG, Rabinovich IB (1973) Tr Khim Khik Tekh 65:812
Hargittai B (2011) Struct Chem 22:1193
Esrafili MD, Alizadeh V (2011) Struct Chem 22:1195
Afeefy HY, Liebman JF (1998) In: Frurip DJ, Irikura KK (eds) Computational thermochemistry: prediction and estimation of molecular thermodynamics. ACS symposium series 677, Washington, DC, pp 94–104
Hamadanian M, Khoshnevisan B, Fotooh FK (2011) Struct Chem 22:1205
Slayden SW, Liebman JF (2008) Struct Chem 19:683
Srinivasan P, Asthana SN, Pawar RB, Kumaradhas P (2011) Struct Chem 22:1213
Jiménez P, Laynez J, Claramunt RM, Sanz D, Fayet JP, Vertut MC, Catalan J, de Paz JLG, Pfister-Guillouzo G, Guimon C, Flammang R, Maquestiau A, Elguero J (1989) New J Chem 13:151
Miranda MS, Matos MAR, Morais VMF, Liebman JF (2011) Struct Chem 22:1221
Matos MAR, Liebman JF (2009) Topics in heterocyclic chemistry, vol 19, Experimental thermochemistry of heterocycles and their aromaticity. In: Gupta RR, Krygowski TM, Cyranski MK (eds) A study of nitrogen, oxygen, and sulfur derivatives of indane and indene. Springer, Heidelberg, pp 1–26
Miranda MS, Matos MAR, Morais VMF, Liebman JF (2011) J Chem Eng Data 56:4516
Seidel RW, Dietz C, Oppel IM (2011) Struct Chem 22:1225
Albert A, Barlin GB (1959) J Chem Soc 2384
Gronneberg T, Undheim K (1972) Org Mass Spectrom 6:823
Beak P, Fry FS Jr, Lee J, Steele F (1976) J Am Chem Soc 98:171
Cook MJ, El-Abbady S, Katritzky AR, Guimon C, Pfister-Guillouzo G (1977) J Chem Soc Perk Trans 2:1652
Theissling CB, Nibbering NMM, Cook MJ, El-Abbady S, Katritaky AR (1977) Tetrahedron Lett 1777
Plano D, Ibáñez E, Palop JA, Sanmartín C (2011) Struct Chem 22:1233
Tel’noi VI, Sheiman MS (1995) Russ Chem Rev 64:309
Liebman JF, Slayden SW (2012) In: Rappoport Z (ed) Patai’s chemistry of functional groups: the chemistry of organoselenium and organotellurium compounds. Wiley, Chichester, pp 139–163
Wang XB, Zhang Y, Wang JS, Yao HQ, Sun HB, Kong LY (2011) Struct Chem 22:1241
Hosmane RS, Liebman JF (1992) Tetrahedron Lett 33:2303
Roux MV, Jiménez P, Martin-Luengo MA, Dávalos JZ, Sun Z, Hosmane RS, Liebman JF (1997) J Org Chem 62:2732
Korkmaz U, Uçar I, Bulut A, Büyükgüngör O (2011) Struct Chem 22:1249
Ribeiro da Silva MDMC, Miranda MS, Vaz CMV, Matos MAR, Acree WE (2005) J Chem Thermodyn 37:49
Kong YX, Di YY, Yang WW, Gao SL, Tan ZC (2010) Acta Chim Slov 57:370
Ahmadi A, Kamfiroozi M, Beheshtian J, Hadipour NL (2011) Struct Chem 22:1261
Svensson M, Humbel S, Froese R, Matsubara T, Sieber S, Morokuma K (1996) J Phys Chem 100:19357
Dapprich S, Komaromi I, Byun K, Morokuma K, Frisch M (1999) J Mol Struct (Theochem) 461:1
Wieland M, Seichter W, Schwarzer A, Weber E (2011) Struct Chem 22:1267
Landrieu P (1905) Compt Rendu 141:358
Landrieu P (1906) Compt Rendu 142:540
Kharasch M (1929) Bur Stand J Res 2:359
Mishra P, Yadav RS, Pandey AC (2011) Struct Chem 22:1281
Fan GC, Chen J, Huang ZY, Jiang JY, Li YF (2011) Wuji Huaxue Xuebao 27:1513
Zhang P, Xu F, Navrotsky A, Lee JS, Kim S, Liu J (2007) Chem Mater 19:5687
Leitgeb B, Janzsó G, Hudoba L, Penke B, Rákhely G, Bogár F (2011) Struct Chem 22:1287
Roles KA, Wunderlich B (1991) Biopolymers 31:477
Roles KA, Xenopoulos A, Wunderlich B (1993) Biopolymers 33:753
You ZL, Wang XL, Zhang JC, Wang C, Zhou XS (2011) Struct Chem 22:1297
Klapötke TM, Deakyne CA, Liebman JF (2011) Struct Chem 22:189
Bradforth SE, Kim EH, Arnold DW, Neumark DM (1993) J Chem Phys 98:800
Dorofeeva OV, Kolesnikova IN, Marochkin II, Ryzhova ON (2011) Struct Chem 22:1303
Khajeh A, Modarress H (2011) Struct Chem 22:1315
Pažout R, Housková J, Dušek M, Maixner J, Kačer P (2011) Struct Chem 22:1325
Vahedpour M, Zolfaghari F (2011) Struct Chem 22:1331
Guthrie JP (1979) Can J Chem 57:454
Li J, Xu L, Jiang N, Zhao L, Li F (2011) Struct Chem 22:1339
Odyakov VF, Zhizhina EG, Matveev KI (2000) Zh Neorg Khim 45:1379
Shariatinia Z, Erben MF, Della Védova CO, Abdous M, Azodi S (2011) Struct Chem 22:1347
Jiang B, Zhou L (2011) Struct Chem 22:1353
Mirzaei M, Eshtiagh-Hosseini H, Alfi N, Aghabozorg H, Attar Gharamaleki J, Beyramabadi SA, Khavasi HR, Salimi AR, Shokrollahi A, Aghaei R, Karami E (2011) Struct Chem 22:1365
Hosmane RS, Liebman JF (2009) Struct Chem 20:693
Gawinecki R, Kolehmainen E, Dobosz RE (2011) Struct Chem 22:1379
Hollóczki O, Nyulászi L (2011) Struct Chem 22:1385
Bedord AF, Heinekey DM, Miller IT, Mortimer CT (1962) J Chem Soc 2982
Wauchope OR, Shakya S, Sawwan N, Liebman JF, Greer A (2007) J Sulf Chem 28:11
Hargittai M (2011) Struct Chem 22:1393
Brenner D (2011) Struct Chem 22:1397
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Ponikvar-Svet, M., Zeiger, D.N. & Liebman, J.F. Interplay of thermochemistry and Structural Chemistry, the journal (volume 22, 2011, issues 4–6) and the discipline. Struct Chem 23, 1267–1280 (2012). https://doi.org/10.1007/s11224-012-0045-8
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DOI: https://doi.org/10.1007/s11224-012-0045-8