Crystallography Open Database

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4022199 CIFC32 H44 N3 O6 P SP 1 21/c 119.2601; 9.9781; 19.7255
90; 114.067; 90
3461.3N. Satish Kumar; Praveen Kommana; J. J. Vittal; K. C. Kumara Swamy
Pentacoordinate Phosphoranes with Reversed Apicophilicity as Stable Intermediates in a Mitsunobu-Type Reaction
Journal of Organic Chemistry, 2002, 67, 6653-6658
4022200 CIFC31 H44 N5 O6 PP 1 21/c 118.0374; 9.7348; 19.0824
90; 94.674; 90
3339.5N. Satish Kumar; Praveen Kommana; J. J. Vittal; K. C. Kumara Swamy
Pentacoordinate Phosphoranes with Reversed Apicophilicity as Stable Intermediates in a Mitsunobu-Type Reaction
Journal of Organic Chemistry, 2002, 67, 6653-6658
4022201 CIFC32 H48 N3 O6 PP 1 21/c 116.2599; 18.4942; 11.2391
90; 101.538; 90
3311.5N. Satish Kumar; Praveen Kommana; J. J. Vittal; K. C. Kumara Swamy
Pentacoordinate Phosphoranes with Reversed Apicophilicity as Stable Intermediates in a Mitsunobu-Type Reaction
Journal of Organic Chemistry, 2002, 67, 6653-6658
4022202 CIFC37 H49 N2 O6 PP 1 21/c 112.0296; 16.3575; 19.1558
90; 106.572; 90
3612.8N. Satish Kumar; Praveen Kommana; J. J. Vittal; K. C. Kumara Swamy
Pentacoordinate Phosphoranes with Reversed Apicophilicity as Stable Intermediates in a Mitsunobu-Type Reaction
Journal of Organic Chemistry, 2002, 67, 6653-6658
4022203 CIFC25 H33 N3 O4C 1 2/c 127.852; 9.5057; 23.098
90; 126.802; 90
4896.6Vito Capriati; Saverio Florio; Renzo Luisi; Maria Teresa Rocchetti
Metalation of 2-Chloromethyl-2-oxazolines: Synthesis of 1,2,3-Tris(oxazolinyl)cyclopropanes and Derivatives
Journal of Organic Chemistry, 2002, 67, 759-763
4022204 CIFC19 H26 N2 O SiP 1 21/n 110.5209; 8.4274; 22.1592
90; 92.433; 90
1962.95Marco Bandini; Pier Giorgio Cozzi; Massimo Giacomini; Paolo Melchiorre; Simona Selva; Achille Umani-Ronchi
Sequential One-Pot InBr~3~-Catalyzed 1,4- then 1,2-Nucleophilic Addition to Enones
Journal of Organic Chemistry, 2002, 67, 3700-3704
4022205 CIF?P 21 21 2118.219; 20.086; 10.365
90; 90; 90
3792Shu-Li You; Xue-Long Hou; Li-Xin Dai; Yi-Hua Yu; Wei Xia
Role of Planar Chirality of S,N- and P,N-Ferrocene Ligands in Palladium-Catalyzed Allylic Substitutions
Journal of Organic Chemistry, 2002, 67, 4684-4695
4022206 CIF?P 1 21 111.341; 15.198; 14.531
90; 99.82; 90
2467Shu-Li You; Xue-Long Hou; Li-Xin Dai; Yi-Hua Yu; Wei Xia
Role of Planar Chirality of S,N- and P,N-Ferrocene Ligands in Palladium-Catalyzed Allylic Substitutions
Journal of Organic Chemistry, 2002, 67, 4684-4695
4022207 CIF?P 21 21 2114.431; 22.102; 12.957
90; 90; 90
4132Shu-Li You; Xue-Long Hou; Li-Xin Dai; Yi-Hua Yu; Wei Xia
Role of Planar Chirality of S,N- and P,N-Ferrocene Ligands in Palladium-Catalyzed Allylic Substitutions
Journal of Organic Chemistry, 2002, 67, 4684-4695
4022208 CIF?P 21 21 2114.561; 25.551; 10.929
90; 90; 90
4066Shu-Li You; Xue-Long Hou; Li-Xin Dai; Yi-Hua Yu; Wei Xia
Role of Planar Chirality of S,N- and P,N-Ferrocene Ligands in Palladium-Catalyzed Allylic Substitutions
Journal of Organic Chemistry, 2002, 67, 4684-4695
4022209 CIFC16 H17 Br O4 PP -15.754; 9.575; 15.766
75.7; 88.81; 74.05
808.2David Crich; Fernando Sartillo-Piscil; Leticia Quintero-Cortes; Donald J. Wink
Radical Contraction of 1,3,2-Dioxaphosphepanes to 1,3,2-Dioxaphosphorinanes: A Kinetic and ^17^O NMR Spectroscopic Study
Journal of Organic Chemistry, 2002, 67, 3360-3364
4022210 CIFC16 H17 O4 PP 1 21/n 16.135; 10.0595; 24.328
90; 92.74; 90
1499.7David Crich; Fernando Sartillo-Piscil; Leticia Quintero-Cortes; Donald J. Wink
Radical Contraction of 1,3,2-Dioxaphosphepanes to 1,3,2-Dioxaphosphorinanes: A Kinetic and ^17^O NMR Spectroscopic Study
Journal of Organic Chemistry, 2002, 67, 3360-3364
4022211 CIFC14 H18 N2 O3P 21 21 216.2571; 12.9524; 16.9737
90; 90; 90
1375.62David M. Casper; Jennifer R. Blackburn; Christopher D. Maroules; Tana Brady; Joel M. Esken; Gregory M. Ferrence; Jean M. Standard; Shawn R. Hitchcock
Conformational Studies of N~3~-Substituted [1,3,4]-Oxadiazinan-2-ones
Journal of Organic Chemistry, 2002, 67, 8871-8876
4022212 CIFC5 H5 B Br N O2P 1 21/c 17.346; 6.938; 13.727
90; 96.62; 90
694.95Paul R. Parry; Changsheng Wang; Andrei S. Batsanov; Martin R. Bryce; Brian Tarbit
Functionalized Pyridylboronic Acids and Their Suzuki Cross-Coupling Reactions To Yield Novel Heteroarylpyridines
Journal of Organic Chemistry, 2002, 67, 7541-7543
4022213 CIFC5 H5 B Br N O2P 1 21/c 17.535; 6.941; 13.877
90; 96.81; 90
720.7Paul R. Parry; Changsheng Wang; Andrei S. Batsanov; Martin R. Bryce; Brian Tarbit
Functionalized Pyridylboronic Acids and Their Suzuki Cross-Coupling Reactions To Yield Novel Heteroarylpyridines
Journal of Organic Chemistry, 2002, 67, 7541-7543
4022214 CIFC5 H5 B Cl N O2P 1 21/n 18.906; 7.277; 10.389
90; 96.55; 90
668.91Paul R. Parry; Changsheng Wang; Andrei S. Batsanov; Martin R. Bryce; Brian Tarbit
Functionalized Pyridylboronic Acids and Their Suzuki Cross-Coupling Reactions To Yield Novel Heteroarylpyridines
Journal of Organic Chemistry, 2002, 67, 7541-7543
4022215 CIFC60 H120 Cl20 N26 Na7 O72R -3 :H21.67; 21.67; 23.534
90; 90; 120
9570.3Carla Bazzicalupi; Andrea Bencini; Emanuela Berni; Antonio Bianchi; Samuele Ciattini; Claudia Giorgi; Sauro Maoggi; Piero Paoletti; Barbara Valtancoli
Synthesis of New Tren-Based Tris-Macrocycles. Anion Cluster Assembling Inside the Cavity Generated by a Bowl-Shaped Receptor
Journal of Organic Chemistry, 2002, 67, 9107-9110
4022216 CIFC34 H26 B Cl8 Cu F4 N4P b c a13.2095; 23.9347; 25.5398
90; 90; 90
8074.8Kevin M. Gillespie; Christopher J. Sanders; Paul O'Shaughnessy; Ian Westmoreland; Christopher P. Thickitt; Peter Scott
Enantioselective Aziridination Using Copper Complexes of Biaryl Schiff Bases
Journal of Organic Chemistry, 2002, 67, 3450-3458
4022217 CIFC39 H42 B Cl2 Cu F4 N4P -19.0255; 14.6531; 15.6437
99.7; 96.215; 101.893
1973.5Kevin M. Gillespie; Christopher J. Sanders; Paul O'Shaughnessy; Ian Westmoreland; Christopher P. Thickitt; Peter Scott
Enantioselective Aziridination Using Copper Complexes of Biaryl Schiff Bases
Journal of Organic Chemistry, 2002, 67, 3450-3458
4022218 CIFC75 H82 Cl2 Cu2 F6 N4 O6 S2P -111.4466; 18.114; 19.5085
69.387; 78.246; 82.443
3698.7Kevin M. Gillespie; Christopher J. Sanders; Paul O'Shaughnessy; Ian Westmoreland; Christopher P. Thickitt; Peter Scott
Enantioselective Aziridination Using Copper Complexes of Biaryl Schiff Bases
Journal of Organic Chemistry, 2002, 67, 3450-3458
4022219 CIFC74 H56 Cu2 F6 N4 O6 S2P -113.309; 16.309; 16.933
67.822; 68.792; 77.318
3158.2Kevin M. Gillespie; Christopher J. Sanders; Paul O'Shaughnessy; Ian Westmoreland; Christopher P. Thickitt; Peter Scott
Enantioselective Aziridination Using Copper Complexes of Biaryl Schiff Bases
Journal of Organic Chemistry, 2002, 67, 3450-3458
4022220 CIFC28 H20 Cl4 N2P 1 21 17.8074; 14.9746; 11.063
90; 103.89; 90
1255.5Kevin M. Gillespie; Christopher J. Sanders; Paul O'Shaughnessy; Ian Westmoreland; Christopher P. Thickitt; Peter Scott
Enantioselective Aziridination Using Copper Complexes of Biaryl Schiff Bases
Journal of Organic Chemistry, 2002, 67, 3450-3458
4022221 CIFC20 H23 N O4 SP 21 21 215.9093; 16.6299; 18.9066
90; 90; 90
1858Kevin M. Gillespie; Christopher J. Sanders; Paul O'Shaughnessy; Ian Westmoreland; Christopher P. Thickitt; Peter Scott
Enantioselective Aziridination Using Copper Complexes of Biaryl Schiff Bases
Journal of Organic Chemistry, 2002, 67, 3450-3458
4022222 CIFC36 H25 F7 O2I 1 2/a 115.57; 15.58; 24.91
90; 91.65; 90
6045Anastasia Detsi; Maria Koufaki; Theodora Calogeropoulou
Synthesis of (Z)-4-Hydroxytamoxifen and (Z)-2-[4-[1-(p-Hydroxyphenyl)-2-phenyl]-1butenyl]phenoxyacetic Acid
Journal of Organic Chemistry, 2002, 67, 4608-4611
4022223 CIFC20 H22 N2 O4 S3P -18.9514; 11.434; 11.871
118.688; 97.82; 91.649
1049.8Ted M. Pappenfus; Jonathan D. Raff; Eric J. Hukkanen; Jason R. Burney; Juan Casado; Steven M. Drew; Larry L. Miller; Kent R. Mann
Dinitro and Quinodimethane Derivatives of Terthiophene That Can Be Both Oxidized and Reduced. Crystal Structures, Spectra, and a Method for Analyzing Quinoid Contributions to Structure
Journal of Organic Chemistry, 2002, 67, 6015-6024
4022224 CIFC13 H17 N3 O SR -3 :H27.4345; 27.4345; 9.47
90; 90; 120
6172.69Barbara Zaleska; Tomasz Bazanek; Robert Socha; Marcin Karelus; Jacek Grochowski; Paweł Serda
Synthesis of Zwitterionic Compounds: Fully Saturated Pyrimidinylium and 1,3-Diazepinylium Derivatives via the Novel Rearrangement of 3-Oxobutanoic Acid Thioanilide Derivatives
Journal of Organic Chemistry, 2002, 67, 4526-4529
4022225 CIFC27 H31 N O3 S2P 21 21 2114.808; 15.348; 11.096
90; 90; 90
2521.8Xiaomei Zhang; Zhaohui Qu; Zhihua Ma; Weifeng Shi; Xianglin Jin; Jianbo Wang
Catalytic Asymmetric [2,3]-Sigmatropic Rearrangement of Sulfur Ylides Generated from Copper(I) Carbenoids and Allyl Sulfides
Journal of Organic Chemistry, 2002, 67, 5621-5625
4022226 CIFC9 H13 O P SP 1 21/n 110.8411; 7.2542; 12.817
90; 101.619; 90
987.32Eric Mattmann; François Mercier; Louis Ricard; François Mathey
Synthesis of New Tricyclic Phosphines and Phosphinites by Intramolecular Diels-Alder Reactions of Trivalent Phospholes
Journal of Organic Chemistry, 2002, 67, 5422-5425
4022227 CIFC10 H15 P SP 1 21/n 19.085; 11.004; 10.314
90; 103.309; 90
1003.5Eric Mattmann; François Mercier; Louis Ricard; François Mathey
Synthesis of New Tricyclic Phosphines and Phosphinites by Intramolecular Diels-Alder Reactions of Trivalent Phospholes
Journal of Organic Chemistry, 2002, 67, 5422-5425
4022228 CIFC42 H43 Fe PP -110.3484; 12.5331; 13.3058
88.715; 78.692; 79.56
1664.06Noriyasu Kataoka; Quinetta Shelby; James P. Stambuli; John F. Hartwig
Air Stable, Sterically Hindered Ferrocenyl Dialkylphosphines for Palladium-Catalyzed C-C, C-N, and C-O Bond-Forming Cross-Couplings
Journal of Organic Chemistry, 2002, 67, 5553-5566
4022229 CIFC96 H94 Fe2 P2P 1 21/n 119.4129; 18.076; 22.333
90; 104.744; 90
7578.6Noriyasu Kataoka; Quinetta Shelby; James P. Stambuli; John F. Hartwig
Air Stable, Sterically Hindered Ferrocenyl Dialkylphosphines for Palladium-Catalyzed C-C, C-N, and C-O Bond-Forming Cross-Couplings
Journal of Organic Chemistry, 2002, 67, 5553-5566
4022230 CIFC36 H28 N2 O8 S2P 1 21/n 112.8237; 18.9157; 13.8409
90; 102.649; 90
3275.89Jye-Shane Yang; Chia-Peng Liu; Bor-Ching Lin; Chih-Wei Tu; Gene-Hsiang Lee
Solid-State Molecular Folding and Supramolecular Structures of Triptycene-Derived Secondary Dicarboxamides
Journal of Organic Chemistry, 2002, 67, 7343-7354
4022231 CIFC43.5 H36 N2 O8.5 S2P 1 21/c 112.0157; 19.0749; 17.5159
90; 103.137; 90
3909.55Jye-Shane Yang; Chia-Peng Liu; Bor-Ching Lin; Chih-Wei Tu; Gene-Hsiang Lee
Solid-State Molecular Folding and Supramolecular Structures of Triptycene-Derived Secondary Dicarboxamides
Journal of Organic Chemistry, 2002, 67, 7343-7354
4022232 CIFC34 H26 O6 S2P -110.6461; 11.2207; 13.3772
91.152; 112.831; 95.824
1462.11Jye-Shane Yang; Chia-Peng Liu; Bor-Ching Lin; Chih-Wei Tu; Gene-Hsiang Lee
Solid-State Molecular Folding and Supramolecular Structures of Triptycene-Derived Secondary Dicarboxamides
Journal of Organic Chemistry, 2002, 67, 7343-7354
4022233 CIFC29 H28 N2 O8 S2C 1 2/c 120.9002; 12.2823; 10.9432
90; 98.144; 90
2780.82Jye-Shane Yang; Chia-Peng Liu; Bor-Ching Lin; Chih-Wei Tu; Gene-Hsiang Lee
Solid-State Molecular Folding and Supramolecular Structures of Triptycene-Derived Secondary Dicarboxamides
Journal of Organic Chemistry, 2002, 67, 7343-7354
4022234 CIFC40 H34 N2 O7 SP -110.6203; 12.3719; 15.0349
66.3144; 70.7873; 82.9391
1708.22Jye-Shane Yang; Chia-Peng Liu; Bor-Ching Lin; Chih-Wei Tu; Gene-Hsiang Lee
Solid-State Molecular Folding and Supramolecular Structures of Triptycene-Derived Secondary Dicarboxamides
Journal of Organic Chemistry, 2002, 67, 7343-7354
4022235 CIFC60 H48 N2 O8 S2P -112.739; 13.309; 14.9414
106.34; 90.259; 96.942
2411.1Jye-Shane Yang; Chia-Peng Liu; Bor-Ching Lin; Chih-Wei Tu; Gene-Hsiang Lee
Solid-State Molecular Folding and Supramolecular Structures of Triptycene-Derived Secondary Dicarboxamides
Journal of Organic Chemistry, 2002, 67, 7343-7354
4022236 CIFC42 H38 N2 O10 S2P n a 2123.1491; 8.7724; 18.7677
90; 90; 90
3811.22Jye-Shane Yang; Chia-Peng Liu; Bor-Ching Lin; Chih-Wei Tu; Gene-Hsiang Lee
Solid-State Molecular Folding and Supramolecular Structures of Triptycene-Derived Secondary Dicarboxamides
Journal of Organic Chemistry, 2002, 67, 7343-7354
4022237 CIFC46 H40 N2 O10 S2P -110.4916; 14.0868; 14.9639
85.767; 81.101; 70.938
2064.49Jye-Shane Yang; Chia-Peng Liu; Bor-Ching Lin; Chih-Wei Tu; Gene-Hsiang Lee
Solid-State Molecular Folding and Supramolecular Structures of Triptycene-Derived Secondary Dicarboxamides
Journal of Organic Chemistry, 2002, 67, 7343-7354
4022238 CIFC26 H22 N2 O8 S2P 21 21 2110.3083; 13.9659; 17.4765
90; 90; 90
2516Jye-Shane Yang; Chia-Peng Liu; Bor-Ching Lin; Chih-Wei Tu; Gene-Hsiang Lee
Solid-State Molecular Folding and Supramolecular Structures of Triptycene-Derived Secondary Dicarboxamides
Journal of Organic Chemistry, 2002, 67, 7343-7354
4022239 CIFC28 H23 Fe PP 1 21 19.332; 11.638; 10.114
90; 106.22; 90
1054.6Henriette Lodberg Pedersen; Mogens Johannsen
Synthesis and Application of Arylmonophosphinoferrocene Ligands: Ultrafast Asymmetric Hydrosilylation of Styrene
Journal of Organic Chemistry, 2002, 67, 7982-7994
4022240 CIFC68 H80 N6 O12C 1 2/c 124.198; 21.102; 27.71
90; 105.591; 90
13628.8Pablo Ballester; Magdalena Capó; Antoni Costa; Pere M. Deyà; Rosa Gomila; Andreas Decken; Ghislain Deslongchamps
Dual Binding Mode of Methylmethanetriacetic Acid to Tripodal Amidopyridine Receptors
Journal of Organic Chemistry, 2002, 67, 8832-8841
4022241 CIFC69 H79 Cl3 N6 O9P -115.531; 15.894; 16.488
66.36; 69.16; 67.34
3341.8Pablo Ballester; Magdalena Capó; Antoni Costa; Pere M. Deyà; Rosa Gomila; Andreas Decken; Ghislain Deslongchamps
Dual Binding Mode of Methylmethanetriacetic Acid to Tripodal Amidopyridine Receptors
Journal of Organic Chemistry, 2002, 67, 8832-8841
4022242 CIFC65 H57 Cl3 N8 O4P -114.4877; 14.8574; 15.1182
107.588; 101.468; 108.218
2787.7Anxin Wu; Arindam Chakraborty; Dariusz Witt; Jason Lagona; Fehmi Damkaci; Marie A. Ofori; Jessica K. Chiles; James C. Fettinger; Lyle Isaacs
Methylene-Bridged Glycoluril Dimers: Synthetic Methods
Journal of Organic Chemistry, 2002, 67, 5817-5830
4022243 CIFC46 H54 N10 O12P n a 2110.7933; 26.35; 16.7931
90; 90; 90
4776.1Anxin Wu; Arindam Chakraborty; Dariusz Witt; Jason Lagona; Fehmi Damkaci; Marie A. Ofori; Jessica K. Chiles; James C. Fettinger; Lyle Isaacs
Methylene-Bridged Glycoluril Dimers: Synthetic Methods
Journal of Organic Chemistry, 2002, 67, 5817-5830
4022244 CIFC42 H48 N8 O12P 1 21/c 120.9952; 16.8963; 11.947
90; 105.506; 90
4083.8Anxin Wu; Arindam Chakraborty; Dariusz Witt; Jason Lagona; Fehmi Damkaci; Marie A. Ofori; Jessica K. Chiles; James C. Fettinger; Lyle Isaacs
Methylene-Bridged Glycoluril Dimers: Synthetic Methods
Journal of Organic Chemistry, 2002, 67, 5817-5830
4022245 CIFC13 H27 F2 N2 O3.5 SP 1 21 16.72; 28.366; 9.655
90; 108.894; 90
1741Donnette D. Staas; Kelly L. Savage; Carl F. Homnick; Nancy N. Tsou; Richard G. Ball
Asymmetric Synthesis of α,α-Difluoro-β-amino Acid Derivatives from Enantiomerically Pure N-tert-Butylsulfinimines
Journal of Organic Chemistry, 2002, 67, 8276-8279
4022246 CIFC15 H25 N O5P 21 21 215.978; 10.568; 27.154
90; 90; 90
1715.5J. Marin; C. Didierjean; A. Aubry; J.-P. Briand; G. Guichard
Diastereoselective Hydroxylation of 6-Substituted Piperidin-2-ones. An Efficient Synthesis of (2S,5R)-5-Hydroxylysine and Related α-Amino Acids
Journal of Organic Chemistry, 2002, 67, 8440-8449
4022247 CIFC15 H25 N O6P 21 21 218.616; 11.688; 17.157
90; 90; 90
1727.78J. Marin; C. Didierjean; A. Aubry; J.-P. Briand; G. Guichard
Diastereoselective Hydroxylation of 6-Substituted Piperidin-2-ones. An Efficient Synthesis of (2S,5R)-5-Hydroxylysine and Related α-Amino Acids
Journal of Organic Chemistry, 2002, 67, 8440-8449
4022248 CIFC17 H26 N O3 SR 3 :H20.698; 20.698; 11.1777
90; 90; 120
4147.1Tony P. Tang; Jonathan A. Ellman
Asymmetric Synthesis of β-Amino Acid Derivatives Incorporating a Broad Range of Substitution Patterns by Enolate Additions to tert-Butanesulfinyl Imines
Journal of Organic Chemistry, 2002, 67, 7819-7832

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