Crystallography Open Database
Search results
Result: there are 300 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching journal of publication like 'Journal of Organic Chemistry' volume of publication is 68
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
4022333 | CIF | C72 H116 Cl N3 Si4 Zn | P c a b | 14.8345; 30.4586; 34.0301 90; 90; 90 | 15376.1 | Alexander Krivokapic; Andrew R. Cowley; Harry L. Anderson Contracted and Expanded meso-Alkynyl Porphyrinoids: from Triphyrin to Hexaphyrin Journal of Organic Chemistry, 2003, 68, 1089-1096 |
4022334 | CIF | C81 H130 Cl2 N4 O Si4 | P -1 | 15.287; 15.617; 19.032 107.214; 106.306; 92.789 | 4122.3 | Alexander Krivokapic; Andrew R. Cowley; Harry L. Anderson Contracted and Expanded meso-Alkynyl Porphyrinoids: from Triphyrin to Hexaphyrin Journal of Organic Chemistry, 2003, 68, 1089-1096 |
4022335 | CIF | C85.5 H136 N4 O2 Si4 Zn | P -1 | 15.403; 17.2992; 18.1735 77.4494; 87.2644; 65.4764 | 4295.47 | Alexander Krivokapic; Andrew R. Cowley; Harry L. Anderson Contracted and Expanded meso-Alkynyl Porphyrinoids: from Triphyrin to Hexaphyrin Journal of Organic Chemistry, 2003, 68, 1089-1096 |
4022336 | CIF | C121 H196 Cl2 N6 O2 Si6 | P -1 | 14.2769; 17.7899; 27.249 73.7478; 74.938; 71.4691 | 6187.72 | Alexander Krivokapic; Andrew R. Cowley; Harry L. Anderson Contracted and Expanded meso-Alkynyl Porphyrinoids: from Triphyrin to Hexaphyrin Journal of Organic Chemistry, 2003, 68, 1089-1096 |
4022337 | CIF | C134 H206 N6 Si6 | P -1 | 18.0634; 18.7545; 19.468 86.4113; 88.034; 86.7733 | 6568.7 | Alexander Krivokapic; Andrew R. Cowley; Harry L. Anderson Contracted and Expanded meso-Alkynyl Porphyrinoids: from Triphyrin to Hexaphyrin Journal of Organic Chemistry, 2003, 68, 1089-1096 |
4022338 | CIF | C82 H126 Cl4 N4 Ni Si4 | P -1 | 15.4377; 17.0745; 18.5033 77.8713; 89.7279; 63.8827 | 4260.11 | Alexander Krivokapic; Andrew R. Cowley; Harry L. Anderson Contracted and Expanded meso-Alkynyl Porphyrinoids: from Triphyrin to Hexaphyrin Journal of Organic Chemistry, 2003, 68, 1089-1096 |
4022339 | CIF | C81 H128 Cl2 N4 O Pt Si4 | P -1 | 15.2923; 15.6848; 18.9901 107.073; 106.186; 93.165 | 4134.71 | Alexander Krivokapic; Andrew R. Cowley; Harry L. Anderson Contracted and Expanded meso-Alkynyl Porphyrinoids: from Triphyrin to Hexaphyrin Journal of Organic Chemistry, 2003, 68, 1089-1096 |
4022340 | CIF | C60 H93 N3 Ni O2 Si3 | P b c a | 18.0619; 22.7317; 29.3777 90; 90; 90 | 12061.8 | Alexander Krivokapic; Andrew R. Cowley; Harry L. Anderson Contracted and Expanded meso-Alkynyl Porphyrinoids: from Triphyrin to Hexaphyrin Journal of Organic Chemistry, 2003, 68, 1089-1096 |
4022341 | CIF | C22 H12 F3 N S | P 1 21/c 1 | 17.465; 11.036; 9.447 90; 97.84; 90 | 1803.8 | Luisa Benati; Gianluca Calestani; Rino Leardini; Matteo Minozzi; Daniele Nanni; Piero Spagnolo; Samantha Strazzari; Giuseppe Zanardi Cascade Radical Reactions via α-(Arylsulfanyl)imidoyl Radicals: Competitive [4 + 2] and [4 + 1] Radical Annulations of Alkynyl Isothiocyanates with Aryl Radicals Journal of Organic Chemistry, 2003, 68, 3454-3464 |
4022342 | CIF | C22 H12 F3 N S | P n m a | 11.347; 7.126; 21.266 90; 90; 90 | 1719.5 | Luisa Benati; Gianluca Calestani; Rino Leardini; Matteo Minozzi; Daniele Nanni; Piero Spagnolo; Samantha Strazzari; Giuseppe Zanardi Cascade Radical Reactions via α-(Arylsulfanyl)imidoyl Radicals: Competitive [4 + 2] and [4 + 1] Radical Annulations of Alkynyl Isothiocyanates with Aryl Radicals Journal of Organic Chemistry, 2003, 68, 3454-3464 |
4022343 | CIF | C21 H12 Cl N S | P 1 21/c 1 | 10.708; 17.02; 9.897 90; 114.51; 90 | 1641.2 | Luisa Benati; Gianluca Calestani; Rino Leardini; Matteo Minozzi; Daniele Nanni; Piero Spagnolo; Samantha Strazzari; Giuseppe Zanardi Cascade Radical Reactions via α-(Arylsulfanyl)imidoyl Radicals: Competitive [4 + 2] and [4 + 1] Radical Annulations of Alkynyl Isothiocyanates with Aryl Radicals Journal of Organic Chemistry, 2003, 68, 3454-3464 |
4022344 | CIF | C21 H12 Cl N S | P 1 21/n 1 | 6.976; 21.822; 10.444 90; 92.7; 90 | 1588.1 | Luisa Benati; Gianluca Calestani; Rino Leardini; Matteo Minozzi; Daniele Nanni; Piero Spagnolo; Samantha Strazzari; Giuseppe Zanardi Cascade Radical Reactions via α-(Arylsulfanyl)imidoyl Radicals: Competitive [4 + 2] and [4 + 1] Radical Annulations of Alkynyl Isothiocyanates with Aryl Radicals Journal of Organic Chemistry, 2003, 68, 3454-3464 |
4022345 | CIF | C22 H15 N O S | P -1 | 10.788; 9.72; 9.567 113.26; 105.57; 102.19 | 828.9 | Luisa Benati; Gianluca Calestani; Rino Leardini; Matteo Minozzi; Daniele Nanni; Piero Spagnolo; Samantha Strazzari; Giuseppe Zanardi Cascade Radical Reactions via α-(Arylsulfanyl)imidoyl Radicals: Competitive [4 + 2] and [4 + 1] Radical Annulations of Alkynyl Isothiocyanates with Aryl Radicals Journal of Organic Chemistry, 2003, 68, 3454-3464 |
4022346 | CIF | C14 H19 N3 O S | P 1 21/a 1 | 13.8549; 6.3197; 16.6171 90; 96.118; 90 | 1446.69 | Barbara Zaleska; Robert Socha; Marcin Karelus; Edward Szneler; Jacek Grochowski; Paweł Serda Synthesis of 1,4-Diazines by Ring Expansion of 1,3-Diazines Journal of Organic Chemistry, 2003, 68, 2334-2337 |
4022347 | CIF | C22 H29 N3 O S | P -1 | 9.47; 9.719; 12.969 71.233; 75.719; 68.799 | 1042.15 | Barbara Zaleska; Robert Socha; Marcin Karelus; Edward Szneler; Jacek Grochowski; Paweł Serda Synthesis of 1,4-Diazines by Ring Expansion of 1,3-Diazines Journal of Organic Chemistry, 2003, 68, 2334-2337 |
4022348 | CIF | C31 H30 N2 O4 S | P 1 | 11.099; 15.508; 16.21 91.344; 100.149; 92.319 | 2743 | Luca Bernardi; Aase S. Gothelf; Rita G. Hazell; Karl Anker Jørgensen Catalytic Asymmetric Mannich Reactions of Glycine Derivatives with Imines. A New Approach to Optically Active α,β-Diamino Acid Derivatives Journal of Organic Chemistry, 2003, 68, 2583-2591 |
4022349 | CIF | C37 H29 N5 | C 1 2/c 1 | 22.1299; 8.6449; 17.6928 90; 121.222; 90 | 2894.6 | Valery N. Kozhevnikov; Dmitry N. Kozhevnikov; Tatiana V. Nikitina; Vladimir L. Rusinov; Oleg N. Chupakhin; Manfred Zabel; Burkhard König A Versatile Strategy for the Synthesis of Functionalized 2,2'-Bi- and 2,2':6',2' '-Terpyridines via Their 1,2,4-Triazine Analogues Journal of Organic Chemistry, 2003, 68, 2882-2888 |
4022350 | CIF | C70 H76 Cl2 O4 S4 | C 1 2/c 1 | 21.617; 15.6187; 20.908 90; 100.26; 90 | 6946.4 | Naoya Morohashi; Hiroshi Katagiri; Nobuhiko Iki; Yusuke Yamane; Chizuko Kabuto; Tetsutaro Hattori; Sotaro Miyano Synthesis of All Stereoisomers of Sulfinylcalix[4]arenes Journal of Organic Chemistry, 2003, 68, 2324-2333 |
4022351 | CIF | C70 H77 N O9 S4 | P 4/n :2 | 15.8724; 15.8724; 12.5804 90; 90; 90 | 3169.4 | Naoya Morohashi; Hiroshi Katagiri; Nobuhiko Iki; Yusuke Yamane; Chizuko Kabuto; Tetsutaro Hattori; Sotaro Miyano Synthesis of All Stereoisomers of Sulfinylcalix[4]arenes Journal of Organic Chemistry, 2003, 68, 2324-2333 |
4022352 | CIF | C69 H73 Cl3 O6 S4 | P -1 | 13.6278; 14.325; 18.048 84.004; 78.644; 68.0693 | 3202.7 | Naoya Morohashi; Hiroshi Katagiri; Nobuhiko Iki; Yusuke Yamane; Chizuko Kabuto; Tetsutaro Hattori; Sotaro Miyano Synthesis of All Stereoisomers of Sulfinylcalix[4]arenes Journal of Organic Chemistry, 2003, 68, 2324-2333 |
4022353 | CIF | C45 H62 O10 S4 | C 1 2/c 1 | 19.65; 13.89; 33.63 90; 91.58; 90 | 9175.4 | Naoya Morohashi; Hiroshi Katagiri; Nobuhiko Iki; Yusuke Yamane; Chizuko Kabuto; Tetsutaro Hattori; Sotaro Miyano Synthesis of All Stereoisomers of Sulfinylcalix[4]arenes Journal of Organic Chemistry, 2003, 68, 2324-2333 |
4022354 | CIF | C45 H57 Cl3 O8 S4 | P -1 | 11.43; 14.94; 16.12 90.73; 105.34; 99.45 | 2640.18 | Naoya Morohashi; Hiroshi Katagiri; Nobuhiko Iki; Yusuke Yamane; Chizuko Kabuto; Tetsutaro Hattori; Sotaro Miyano Synthesis of All Stereoisomers of Sulfinylcalix[4]arenes Journal of Organic Chemistry, 2003, 68, 2324-2333 |
4022355 | CIF | C45 H60 O9 S4 | P 1 21/m 1 | 11.2043; 15.275; 14.901 90; 96.4206; 90 | 2534.3 | Naoya Morohashi; Hiroshi Katagiri; Nobuhiko Iki; Yusuke Yamane; Chizuko Kabuto; Tetsutaro Hattori; Sotaro Miyano Synthesis of All Stereoisomers of Sulfinylcalix[4]arenes Journal of Organic Chemistry, 2003, 68, 2324-2333 |
4022356 | CIF | C45 H57 Cl3 O8 S4 | P 1 21/n 1 | 15.7107; 21.663; 15.285 90; 102.772; 90 | 5073.4 | Naoya Morohashi; Hiroshi Katagiri; Nobuhiko Iki; Yusuke Yamane; Chizuko Kabuto; Tetsutaro Hattori; Sotaro Miyano Synthesis of All Stereoisomers of Sulfinylcalix[4]arenes Journal of Organic Chemistry, 2003, 68, 2324-2333 |
4022357 | CIF | C31 H48 O6 S | P 1 21 1 | 13.4385; 7.1053; 16.4827 90; 107.8; 90 | 1498.5 | Andrés García-Granados; Pilar E. López; Enrique Melguizo; Juan N. Moliz; Andrés Parra; Yolanda Simeó; José A. Dobado Epoxides, Cyclic Sulfites, and Sulfate from Natural Pentacyclic Triterpenoids: Theoretical Calculations and Chemical Transformations Journal of Organic Chemistry, 2003, 68, 4833-4844 |
4022358 | CIF | C24 H10 N O2 | P b c n | 12.2443; 12.454; 11.9541 90; 90; 90 | 1822.9 | Jason E. Field; Thomas J. Hill; D. Venkataraman Bridged Triarylamines: A New Class of Heterohelicenes Journal of Organic Chemistry, 2003, 68, 6071-6078 |
4022359 | CIF | C28 H21 N O2 | P 1 21/c 1 | 8.8628; 11.4131; 20.4548 90; 93.2904; 90 | 2065.63 | Jason E. Field; Thomas J. Hill; D. Venkataraman Bridged Triarylamines: A New Class of Heterohelicenes Journal of Organic Chemistry, 2003, 68, 6071-6078 |
4022360 | CIF | C32 H23 N O2 | C 1 2/c 1 | 17.986; 13.832; 11.967 90; 128.574; 90 | 2327.7 | Jason E. Field; Thomas J. Hill; D. Venkataraman Bridged Triarylamines: A New Class of Heterohelicenes Journal of Organic Chemistry, 2003, 68, 6071-6078 |
4022361 | CIF | C23 H21 N O4 | P -1 | 10.1343; 10.1351; 11.8738 111.002; 113.436; 96.5529 | 996.63 | Jason E. Field; Thomas J. Hill; D. Venkataraman Bridged Triarylamines: A New Class of Heterohelicenes Journal of Organic Chemistry, 2003, 68, 6071-6078 |
4022362 | CIF | C21 H13 N O2 | P 1 21/n 1 | 3.9442; 10.3945; 34.639 90; 91.587; 90 | 1419.6 | Jason E. Field; Thomas J. Hill; D. Venkataraman Bridged Triarylamines: A New Class of Heterohelicenes Journal of Organic Chemistry, 2003, 68, 6071-6078 |
4022363 | CIF | C12 H17 Br | P n m a | 9.6439; 7.3388; 16.8992 90; 90; 90 | 1196.04 | Jason E. Field; Thomas J. Hill; D. Venkataraman Bridged Triarylamines: A New Class of Heterohelicenes Journal of Organic Chemistry, 2003, 68, 6071-6078 |
4022364 | CIF | C26 H27 N O4 | P 1 21/c 1 | 12.1636; 17.4913; 11.8633 90; 110.623; 90 | 2362.26 | Jason E. Field; Thomas J. Hill; D. Venkataraman Bridged Triarylamines: A New Class of Heterohelicenes Journal of Organic Chemistry, 2003, 68, 6071-6078 |
4022365 | CIF | C34 H31 N O4 | P -1 | 10.9431; 11.7705; 12.3238 99.2171; 92.7484; 115.082 | 1407.17 | Jason E. Field; Thomas J. Hill; D. Venkataraman Bridged Triarylamines: A New Class of Heterohelicenes Journal of Organic Chemistry, 2003, 68, 6071-6078 |
4022366 | CIF | C20 H15 N | P 1 21/c 1 | 10.4907; 10.9269; 14.5995 90; 120; 90 | 1431.8 | Jason E. Field; Thomas J. Hill; D. Venkataraman Bridged Triarylamines: A New Class of Heterohelicenes Journal of Organic Chemistry, 2003, 68, 6071-6078 |
4022367 | CIF | C28 H36 Cl28 N4 O4 Sb4 | C 1 2/c 1 | 10.87; 20.407; 28.548 90; 90; 90 | 6333 | S. V. Rosokha; S. V. Lindeman; R. Rathore; J. K. Kochi Molecular Recognition of NO/NO^+^ via Multicenter (Charge-Transfer) Binding to Bridged Diarene Donors. Effect of Structure on the Optical Transitions and Complexation Thermodynamics Journal of Organic Chemistry, 2003, 68, 3947-3957 |
4022368 | CIF | C25 H32 Cl14 N2 O2 Sb2 | P -1 | 10.8602; 13.1116; 14.8897 77.221; 83.298; 81.585 | 2037.6 | S. V. Rosokha; S. V. Lindeman; R. Rathore; J. K. Kochi Molecular Recognition of NO/NO^+^ via Multicenter (Charge-Transfer) Binding to Bridged Diarene Donors. Effect of Structure on the Optical Transitions and Complexation Thermodynamics Journal of Organic Chemistry, 2003, 68, 3947-3957 |
4022369 | CIF | C37.5 H35 Cl9 N O Sb | C 1 2/c 1 | 36.694; 11.8971; 21.742 90; 124.507; 90 | 7821.7 | S. V. Rosokha; S. V. Lindeman; R. Rathore; J. K. Kochi Molecular Recognition of NO/NO^+^ via Multicenter (Charge-Transfer) Binding to Bridged Diarene Donors. Effect of Structure on the Optical Transitions and Complexation Thermodynamics Journal of Organic Chemistry, 2003, 68, 3947-3957 |
4022370 | CIF | C28.5 H41 Cl13 N2 O2 Sb2 | P 1 21/n 1 | 19.4836; 13.9952; 32.7838 90; 98.837; 90 | 8833.3 | S. V. Rosokha; S. V. Lindeman; R. Rathore; J. K. Kochi Molecular Recognition of NO/NO^+^ via Multicenter (Charge-Transfer) Binding to Bridged Diarene Donors. Effect of Structure on the Optical Transitions and Complexation Thermodynamics Journal of Organic Chemistry, 2003, 68, 3947-3957 |
4022371 | CIF | C39 H67 N4 O11 P Si2 | P 21 21 21 | 12.2964; 18.7203; 20.581 90; 90; 90 | 4737.6 | Xuemei Chen; David F. Wiemer Synthesis of 5'-Amino-5'-phosphonate Analogues of Pyrimidine Nucleoside Monophosphates Journal of Organic Chemistry, 2003, 68, 6108-6114 |
4022372 | CIF | C24 H20 Co2 O7 | P n a 21 | 16.902; 15.406; 18.03 90; 90; 90 | 4695.1 | David R. Carbery; Serge Reignier; Neil D. Miller; Harry Adams; Joseph P. A. Harrity Investigation of a Stereoselective Co-Mediated Rearrangement Reaction Journal of Organic Chemistry, 2003, 68, 4392-4399 |
4022373 | CIF | C24 H22 Co2 O7 | P 1 21/c 1 | 16.4131; 13.057; 23.774 90; 110.138; 90 | 4783.4 | David R. Carbery; Serge Reignier; Neil D. Miller; Harry Adams; Joseph P. A. Harrity Investigation of a Stereoselective Co-Mediated Rearrangement Reaction Journal of Organic Chemistry, 2003, 68, 4392-4399 |
4022374 | CIF | C24 H22 Co2 O7 | P b c n | 32.378; 15.971; 9.371 90; 90; 90 | 4846 | David R. Carbery; Serge Reignier; Neil D. Miller; Harry Adams; Joseph P. A. Harrity Investigation of a Stereoselective Co-Mediated Rearrangement Reaction Journal of Organic Chemistry, 2003, 68, 4392-4399 |
4022375 | CIF | C23 H20 Co2 O7 | P -1 | 8.6166; 11.364; 11.585 94.123; 96.558; 92.581 | 1122.4 | David R. Carbery; Serge Reignier; Neil D. Miller; Harry Adams; Joseph P. A. Harrity Investigation of a Stereoselective Co-Mediated Rearrangement Reaction Journal of Organic Chemistry, 2003, 68, 4392-4399 |
4022376 | CIF | C24 H24 O | P 21 21 21 | 9.2085; 13.517; 15.355 90; 90; 90 | 1911.3 | Ming-Shyong Yang; Shyue-Sheng Lu; Chitneni Prasad Rao; Yow-Fu Tsai; Chun-Chen Liao Photochemistry of Bicyclo[2.2.2]oct-7-ene-2,5-diones and the Corresponding 5-Hydroxyimino and 5-Methylene Derivatives Journal of Organic Chemistry, 2003, 68, 6543-6553 |
4022377 | CIF | C17 H13 N3 O | P -1 | 8.115; 9.3; 9.695 74.074; 85.712; 85.968 | 700.68 | Wolfgang Holzer; Rosa M. Claramunt; Marta Pérez-Torralba; Davide Guggi; Thomas H. Brehmer Spiro-fused (C2)-Azirino-(C4)-Pyrazolones - a New Heterocyclic System, Synthesis, Spectroscopic Studies and X-Ray Structure Analysis Journal of Organic Chemistry, 2003, 68, 7943-7950 |
4022378 | CIF | C18 H15 N3 O | P 21 21 21 | 4.825; 10.766; 29.502 90; 90; 90 | 1532.51 | Wolfgang Holzer; Rosa M. Claramunt; Marta Pérez-Torralba; Davide Guggi; Thomas H. Brehmer Spiro-fused (C2)-Azirino-(C4)-Pyrazolones - a New Heterocyclic System, Synthesis, Spectroscopic Studies and X-Ray Structure Analysis Journal of Organic Chemistry, 2003, 68, 7943-7950 |
4022379 | CIF | C32 H26 Cl2 N O10 S2 | P 1 21/c 1 | 9.0344; 16.368; 21.868 90; 100.84; 90 | 3176 | Henry J. Shine; Bingjun Zhao; Ding-Quan Qian; John N. Marx; Ilse Y. Guzmán-Jiménez; John H. Thurston; T. Ould-Ely; Kenton H. Whitmire Adducts of Phenoxathiin and Thianthrene Cation Radicals with Alkenes and Cycloalkenes Journal of Organic Chemistry, 2003, 68, 8910-8917 |
4022380 | CIF | C29 H24 Cl1.97 O9.89 S2 | C 1 2/c 1 | 16.803; 13.651; 12.88 90; 105.57; 90 | 2846 | Henry J. Shine; Bingjun Zhao; Ding-Quan Qian; John N. Marx; Ilse Y. Guzmán-Jiménez; John H. Thurston; T. Ould-Ely; Kenton H. Whitmire Adducts of Phenoxathiin and Thianthrene Cation Radicals with Alkenes and Cycloalkenes Journal of Organic Chemistry, 2003, 68, 8910-8917 |
4022381 | CIF | C31 H28 Cl2 O10 S2 | P 1 21/n 1 | 14.198; 13.998; 15.977 90; 108; 90 | 3019.9 | Henry J. Shine; Bingjun Zhao; Ding-Quan Qian; John N. Marx; Ilse Y. Guzmán-Jiménez; John H. Thurston; T. Ould-Ely; Kenton H. Whitmire Adducts of Phenoxathiin and Thianthrene Cation Radicals with Alkenes and Cycloalkenes Journal of Organic Chemistry, 2003, 68, 8910-8917 |
4022382 | CIF | C34 H31 Cl2 N O10.31 S2 | P 1 21/c 1 | 9.3351; 16.983; 21.505 90; 99.85; 90 | 3359.2 | Henry J. Shine; Bingjun Zhao; Ding-Quan Qian; John N. Marx; Ilse Y. Guzmán-Jiménez; John H. Thurston; T. Ould-Ely; Kenton H. Whitmire Adducts of Phenoxathiin and Thianthrene Cation Radicals with Alkenes and Cycloalkenes Journal of Organic Chemistry, 2003, 68, 8910-8917 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!