Crystallography Open Database

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4021218 CIFC74 H66 Cl10 N2 O2 P2 Pd2P 110.841; 12.86; 13.625
100.916; 96.331; 104.576
1780Hiroto Nakano; Kouichi Takahashi; Yuko Okuyama; Chieko Senoo; Natsumi Tsugawa; Yuichiro Suzuki; Reiko Fujita; Kazuo Sasaki; Chizuko Kabuto
Chiral Phosphinooxazolidine Ligands for Palladium- and Platinum-Catalyzed Asymmetric Diels-Alder Reactions
Journal of Organic Chemistry, 2004, 69, 7092-7100
4021219 CIFC37 H33 Cl5 N O P PtP 21 21 2111.253; 14.021; 22.776
90; 90; 90
3593.8Hiroto Nakano; Kouichi Takahashi; Yuko Okuyama; Chieko Senoo; Natsumi Tsugawa; Yuichiro Suzuki; Reiko Fujita; Kazuo Sasaki; Chizuko Kabuto
Chiral Phosphinooxazolidine Ligands for Palladium- and Platinum-Catalyzed Asymmetric Diels-Alder Reactions
Journal of Organic Chemistry, 2004, 69, 7092-7100
4021220 CIFC40 H40 Cl2 N O4 P PdP 21 21 2130.16; 14.1; 17.32
90; 90; 90
7365.4Hiroto Nakano; Kouichi Takahashi; Yuko Okuyama; Chieko Senoo; Natsumi Tsugawa; Yuichiro Suzuki; Reiko Fujita; Kazuo Sasaki; Chizuko Kabuto
Chiral Phosphinooxazolidine Ligands for Palladium- and Platinum-Catalyzed Asymmetric Diels-Alder Reactions
Journal of Organic Chemistry, 2004, 69, 7092-7100
4021221 CIFC36 H32 Cl2 N O2 P PdP 1 21 112.259; 10.597; 12.465
90; 93.697; 90
1615.9Hiroto Nakano; Kouichi Takahashi; Yuko Okuyama; Chieko Senoo; Natsumi Tsugawa; Yuichiro Suzuki; Reiko Fujita; Kazuo Sasaki; Chizuko Kabuto
Chiral Phosphinooxazolidine Ligands for Palladium- and Platinum-Catalyzed Asymmetric Diels-Alder Reactions
Journal of Organic Chemistry, 2004, 69, 7092-7100
4021222 CIFC39 H35 Cl5 N O P PdP 21 21 2112.785; 14.625; 19.215
90; 90; 90
3593Hiroto Nakano; Kouichi Takahashi; Yuko Okuyama; Chieko Senoo; Natsumi Tsugawa; Yuichiro Suzuki; Reiko Fujita; Kazuo Sasaki; Chizuko Kabuto
Chiral Phosphinooxazolidine Ligands for Palladium- and Platinum-Catalyzed Asymmetric Diels-Alder Reactions
Journal of Organic Chemistry, 2004, 69, 7092-7100
4021223 CIFC24 H29 N O3P 21 21 212.12; 18.035; 9.63
90; 90; 90
2105Katsunori Tanaka; Toyoharu Kobayashi; Hajime Mori; Shigeo Katsumura
Development of Highly Stereoselective Asymmetric 6π-Azaelectrocyclization of Conformationally Flexible Linear 1-Azatrienes. From Determination of Multifunctional Chiral Amines, 7-Alkyl cis-1-Amino-2-indanols, to Application as a New Synthetic Strategy: Formal Synthesis of 20-Epiuleine
Journal of Organic Chemistry, 2004, 69, 5906-5925
4021224 CIFC30 H30 N O PP 1 a 111.4839; 13.9771; 11.4027
90; 45.477; 90
1304.93Takahiro Nishimura; Yoshiki Nishiguchi; Yasunari Maeda; Sakae Uemura
Palladium-Catalyzed Transformation of Cyclobutanone O-Benzoyloximes to Nitriles via C-C Bond Cleavage
Journal of Organic Chemistry, 2004, 69, 5342-5347
4021225 CIFC28 H26 Fe O4P 1 21/c 19.685; 20.895; 11.748
90; 108.501; 90
2254.6Shin-ichi Fukuzawa; Daisuke Wachi; Takashi Suzuki; Satoshi Itoh
Regioselective Aminolysis and Hydrolysis of Chiral 1,4-Ferrocenyl Diacetate
Journal of Organic Chemistry, 2004, 69, 4991-4996
4021226 CIFC156 H152 Fe6 O12P 114.79; 15.017; 17.581
107.85; 92.253; 119.304
3155.8Shin-ichi Fukuzawa; Daisuke Wachi; Takashi Suzuki; Satoshi Itoh
Regioselective Aminolysis and Hydrolysis of Chiral 1,4-Ferrocenyl Diacetate
Journal of Organic Chemistry, 2004, 69, 4991-4996
4021227 CIFC28 H26 Fe O4P 1 21 111.453; 7.475; 14.766
90; 105.35; 90
1219Shin-ichi Fukuzawa; Daisuke Wachi; Takashi Suzuki; Satoshi Itoh
Regioselective Aminolysis and Hydrolysis of Chiral 1,4-Ferrocenyl Diacetate
Journal of Organic Chemistry, 2004, 69, 4991-4996
4021228 CIFC26 H25 Fe N O2P 1 21 111.342; 8.556; 11.415
90; 70.701; 90
1045.6Shin-ichi Fukuzawa; Daisuke Wachi; Takashi Suzuki; Satoshi Itoh
Regioselective Aminolysis and Hydrolysis of Chiral 1,4-Ferrocenyl Diacetate
Journal of Organic Chemistry, 2004, 69, 4991-4996
4021229 CIFC26 H27 Fe N OP 21 21 2112.374; 23.286; 7.684
90; 90; 90
2214.3Shin-ichi Fukuzawa; Daisuke Wachi; Takashi Suzuki; Satoshi Itoh
Regioselective Aminolysis and Hydrolysis of Chiral 1,4-Ferrocenyl Diacetate
Journal of Organic Chemistry, 2004, 69, 4991-4996
4021230 CIFC16 H10 N2 O2P 1 21/a 18.1918; 11.178; 13.5924
90; 96.492; 90
1236.65Amit Basak; Subhendu Sekhar Bag; Pooja Anjali Majumder; Amit Kumar Das; Valerio Bertolasi
Effect of Remote Trigonal Carbons on the Kinetics of Bergman Cyclization: Synthesis and Chemical Reactivity of Pyridazinedione-Based Enediynes
Journal of Organic Chemistry, 2004, 69, 6927-6930
4021231 CIFC16 H12 N2 O2C 1 c 115.6042; 8.7485; 11.0256
90; 120.186; 90
1301.04Amit Basak; Subhendu Sekhar Bag; Pooja Anjali Majumder; Amit Kumar Das; Valerio Bertolasi
Effect of Remote Trigonal Carbons on the Kinetics of Bergman Cyclization: Synthesis and Chemical Reactivity of Pyridazinedione-Based Enediynes
Journal of Organic Chemistry, 2004, 69, 6927-6930
4021232 CIFC10 H8 N2 O2P c c n14.4551; 16.5721; 8.0504
90; 90; 90
1928.48Amit Basak; Subhendu Sekhar Bag; Pooja Anjali Majumder; Amit Kumar Das; Valerio Bertolasi
Effect of Remote Trigonal Carbons on the Kinetics of Bergman Cyclization: Synthesis and Chemical Reactivity of Pyridazinedione-Based Enediynes
Journal of Organic Chemistry, 2004, 69, 6927-6930
4021233 CIFC30 H28 Si2P 21 21 2110.015; 14.07; 17.975
90; 90; 90
2532.8Keigo Suzuki; Yusuke Kawakami; Devadasan Velmurugan; Takashi Yamane
Stereoselective Synthesis of Optically Active Disilanes and Selective Functionalization by the Cleavage of Silicon-Naphthyl Bonds with Bromine
Journal of Organic Chemistry, 2004, 69, 5383-5389
4021234 CIFC100.5 H117 N4 O4.5P 1 21/c 123.275; 18.33; 22.8247
90; 116.592; 90
8707.8Jonathan P. Hill; Ian J. Hewitt; Christopher E. Anson; Annie K. Powell; Amy Lea McCarty; Paul A. Karr; Melvin E. Zandler; Francis D'Souza
Highly Nonplanar, Electron Deficient, N-Substituted tetra-Oxocyclohexadienylidene Porphyrinogens: Structural, Computational, and Electrochemical Investigations
Journal of Organic Chemistry, 2004, 69, 5861-5869
4021235 CIFC110 H130 N4 O4P 1 21/c 122.669; 20.1; 23.474
90; 118.169; 90
9429Jonathan P. Hill; Ian J. Hewitt; Christopher E. Anson; Annie K. Powell; Amy Lea McCarty; Paul A. Karr; Melvin E. Zandler; Francis D'Souza
Highly Nonplanar, Electron Deficient, N-Substituted tetra-Oxocyclohexadienylidene Porphyrinogens: Structural, Computational, and Electrochemical Investigations
Journal of Organic Chemistry, 2004, 69, 5861-5869
4021236 CIFC26 H29 N2 O3 PP 21 21 2112.448; 22.616; 8.839
90; 90; 90
2488.5Yoshinori Kohmura; Toshiaki Mase
A Highly Stereoselective Synthesis of Optically Active Trisubstituted 1,2-Ethylenediamines: The First Example of Grignard Addition to N-Diphenylphosphinoyl Ketimines Derived from Amino Acids
Journal of Organic Chemistry, 2004, 69, 6329-6334
4021237 CIFC40 H40 O8C 1 2/c 130.022; 8.7667; 25.924
90; 91.413; 90
6821Jun-Li Hou; Mu-Xin Jia; Xi-Kui Jiang; Zhan-Ting Li; Guang-Ju Chen
Solvophobically-Driven Oligo(ethylene glycol) Helical Foldamers. Synthesis, Characterization, and Complexation with Ethane-1,2-diaminium
Journal of Organic Chemistry, 2004, 69, 6228-6237
4021238 CIFC28 H28 N2 O6 SP 21 21 216.45; 18.538; 20.6
90; 90; 90
2463.1Alisher B. Khasanov; Michele M. Ramirez-Weinhouse; Thomas R. Webb; Mohan Thiruvazhi
Novel Asymmetric Approach to Proline-Derived Spiro-β-lactams
Journal of Organic Chemistry, 2004, 69, 5766-5769
4021239 CIFC153.5 H106 Cl8.18P -114.229; 18.035; 25.137
72.471; 88.187; 80.469
6065.1Jishan Wu; Željko Tomovič; Volker Enkelmann; Klaus Müllen
From Branched Hydrocarbon Propellers to C~3~-Symmetric Graphite Disks
Journal of Organic Chemistry, 2004, 69, 5179-5186
4021240 CIFC52 H68 O10P -111.84; 18.897; 11.573
104.16; 96.25; 82.52
2481Noa Seri; Iris Thondorf; Silvio E. Biali
Preparation and Conformation of Dioxocalix[4]arene Derivatives
Journal of Organic Chemistry, 2004, 69, 4774-4780
4021241 CIFC56 H62 N2 O12P 1 21/c 115.4; 12.935; 27.73
90; 105.76; 90
5317Noa Seri; Iris Thondorf; Silvio E. Biali
Preparation and Conformation of Dioxocalix[4]arene Derivatives
Journal of Organic Chemistry, 2004, 69, 4774-4780
4021242 CIFC44 H53.36 O6.68P 1 21/n 18.6067; 14.92; 14.587
90; 93.004; 90
1870.6Noa Seri; Iris Thondorf; Silvio E. Biali
Preparation and Conformation of Dioxocalix[4]arene Derivatives
Journal of Organic Chemistry, 2004, 69, 4774-4780
4021243 CIFC24 H26 N O2 PP 1 21 111.274; 16.489; 11.217
90; 90; 90
2085Youichi Tanaka; Takashi Mino; Koji Akita; Masami Sakamoto; Tsutomu Fujita
Development of Chiral (S)-Prolinol-Derived Ligands for Palladium-Catalyzed Asymmetric Allylic Alkylation: Effect of a Siloxymethyl Group on the Pyrrolidine Backbone
Journal of Organic Chemistry, 2004, 69, 6679-6687
4021244 CIFC27 H34 N O2 P SiP 115.651; 6.518; 12.89
90; 96.18; 90
1307.3Youichi Tanaka; Takashi Mino; Koji Akita; Masami Sakamoto; Tsutomu Fujita
Development of Chiral (S)-Prolinol-Derived Ligands for Palladium-Catalyzed Asymmetric Allylic Alkylation: Effect of a Siloxymethyl Group on the Pyrrolidine Backbone
Journal of Organic Chemistry, 2004, 69, 6679-6687
4021245 CIFC25 H29 Cl2 N O2.5 P PdP 110.4; 11.376; 11.875
64.595; 73.545; 80.628
1215.7Youichi Tanaka; Takashi Mino; Koji Akita; Masami Sakamoto; Tsutomu Fujita
Development of Chiral (S)-Prolinol-Derived Ligands for Palladium-Catalyzed Asymmetric Allylic Alkylation: Effect of a Siloxymethyl Group on the Pyrrolidine Backbone
Journal of Organic Chemistry, 2004, 69, 6679-6687
4021246 CIFC52 H63 Cl2 I O4P b c a25.1927; 12.5759; 30.9084
90; 90; 90
9792.4Arjan W. Kleij; Beatriz Souto; César J. Pastor; Pilar Prados; Javier de Mendoza
Multinuclear Calixarene Synthons with Covalently Linked Aryl-Palladium(II) Complexes
Journal of Organic Chemistry, 2004, 69, 6394-6403
4021247 CIFC86 H102 Cl6 I2 O6P 1 21/n 115.1582; 26.6443; 22.1283
90; 101.198; 90
8767Arjan W. Kleij; Beatriz Souto; César J. Pastor; Pilar Prados; Javier de Mendoza
Multinuclear Calixarene Synthons with Covalently Linked Aryl-Palladium(II) Complexes
Journal of Organic Chemistry, 2004, 69, 6394-6403
4021248 CIFC13 H16 N5 O2P 21 21 216.0831; 11.3917; 20.053
90; 90; 90
1389.6Paul R. Serwinski; Burak Esat; Paul M. Lahti; Yi Liao; Richard Walton; Jiang Lan
Photolysis and Oxidation of Azidophenyl-Substituted Radicals: Delocalization in Heteroatom-Based Radicals
Journal of Organic Chemistry, 2004, 69, 5247-5260
4021249 CIFC26 H20 N7P 1 21/c 16.5406; 13.1924; 25.7914
90; 95.0885; 90
2216.67Paul R. Serwinski; Burak Esat; Paul M. Lahti; Yi Liao; Richard Walton; Jiang Lan
Photolysis and Oxidation of Azidophenyl-Substituted Radicals: Delocalization in Heteroatom-Based Radicals
Journal of Organic Chemistry, 2004, 69, 5247-5260
4021251 CIFC13 H16 N5 O2P 1 21/c 17.3818; 17.5152; 12.1987
90; 120; 90
1407.07Paul R. Serwinski; Burak Esat; Paul M. Lahti; Yi Liao; Richard Walton; Jiang Lan
Photolysis and Oxidation of Azidophenyl-Substituted Radicals: Delocalization in Heteroatom-Based Radicals
Journal of Organic Chemistry, 2004, 69, 5247-5260
4021252 CIFC13 H16 Cl N5 O6P 1 21/c 17.6357; 16.5403; 13.775
90; 105.379; 90
1677.44Paul R. Serwinski; Burak Esat; Paul M. Lahti; Yi Liao; Richard Walton; Jiang Lan
Photolysis and Oxidation of Azidophenyl-Substituted Radicals: Delocalization in Heteroatom-Based Radicals
Journal of Organic Chemistry, 2004, 69, 5247-5260
4021253 CIFC13 H16 Cl N5 O6P 1 21/c 17.263; 13.449; 16.958
90; 101.283; 90
1624.4Paul R. Serwinski; Burak Esat; Paul M. Lahti; Yi Liao; Richard Walton; Jiang Lan
Photolysis and Oxidation of Azidophenyl-Substituted Radicals: Delocalization in Heteroatom-Based Radicals
Journal of Organic Chemistry, 2004, 69, 5247-5260
4021254 CIFC19 H14 O SP 1 21/n 19.8869; 10.2778; 15.52
90; 105.827; 90
1517.3Kuo-Jui Chang; Dinesh Kumar Rayabarapu; Chien-Hong Cheng
Cobalt-Catalyzed Regioselective Carbocyclization Reaction of o-Iodophenyl Ketones and Aldehydes with Alkynes, Acrylates, and Acrylonitrile: A Facile Route to Indenols and Indenes
Journal of Organic Chemistry, 2004, 69, 4781-4787
4021255 CIFC18 H14 N2 O2P 1 21/n 13.907; 23.189; 8.02
90; 97.83; 90
719.8Hsiu-Chih Yeh; Wei-Ching Wu; Yuh-Sheng Wen; De-Chang Dai; Juen-Kai Wang; Chin-Ti Chen
Derivative of α,β-Dicyanostilbene: Convenient Precursor for the Synthesis of Diphenylmaleimide Compounds, E-Z Isomerization, Crystal Structure, and Solid-State Fluorescence
Journal of Organic Chemistry, 2004, 69, 6455-6462
4021256 CIFC16 H8 Br2 N2P -17.9926; 9.4626; 10.6914
92.131; 110.063; 74.017
728.7Hsiu-Chih Yeh; Wei-Ching Wu; Yuh-Sheng Wen; De-Chang Dai; Juen-Kai Wang; Chin-Ti Chen
Derivative of α,β-Dicyanostilbene: Convenient Precursor for the Synthesis of Diphenylmaleimide Compounds, E-Z Isomerization, Crystal Structure, and Solid-State Fluorescence
Journal of Organic Chemistry, 2004, 69, 6455-6462
4021257 CIFC18 H8 F6 N2P 1 21/n 18.0332; 11.976; 8.721
90; 115.331; 90
758.34Hsiu-Chih Yeh; Wei-Ching Wu; Yuh-Sheng Wen; De-Chang Dai; Juen-Kai Wang; Chin-Ti Chen
Derivative of α,β-Dicyanostilbene: Convenient Precursor for the Synthesis of Diphenylmaleimide Compounds, E-Z Isomerization, Crystal Structure, and Solid-State Fluorescence
Journal of Organic Chemistry, 2004, 69, 6455-6462
4021258 CIFC16 H17 N O2P 1 21 15.525; 30.929; 8.114
90; 95.724; 90
1379.63Masakazu Atobe; Naoki Yamazaki; Chihiro Kibayashi
Enantioselective Synthesis of Primary 1-(Aryl)alkylamines by Nucleophilic 1,2-Addition of Organolithium Reagents to Hydroxyoxime Ethers and Application to Asymmetric Synthesis of G-Protein-Coupled Receptor Ligands
Journal of Organic Chemistry, 2004, 69, 5595-5607
4021259 CIFC41.8 H30.8 Cl5.4 F3 N4 Ni O6P 21 21 2110.6008; 17.7561; 22.3322
90; 90; 90
4203.6Vadim A. Soloshonok; Hisanori Ueki; Rohit Tiwari; Chaozhong Cai; Victor J. Hruby
Virtually Complete Control of Simple and Face Diastereoselectivity in the Michael Addition Reactions between Achiral Equivalents of a Nucleophilic Glycine and (S)- or (R)-3-(E-Enoyl)-4-phenyl-1,3-oxazolidin-2-ones: Practical Method for Preparation of β-Substituted Pyroglutamic Acids and Prolines
Journal of Organic Chemistry, 2004, 69, 4984-4990
4021260 CIFC36 H34 Cl2 N4 Ni O8P 21 21 2113.416; 14.882; 16.949
90; 90; 90
3384.1Vadim A. Soloshonok; Hisanori Ueki; Rohit Tiwari; Chaozhong Cai; Victor J. Hruby
Virtually Complete Control of Simple and Face Diastereoselectivity in the Michael Addition Reactions between Achiral Equivalents of a Nucleophilic Glycine and (S)- or (R)-3-(E-Enoyl)-4-phenyl-1,3-oxazolidin-2-ones: Practical Method for Preparation of β-Substituted Pyroglutamic Acids and Prolines
Journal of Organic Chemistry, 2004, 69, 4984-4990
4021261 CIFC22 H19 Br N2 OP 1 21/n 110.4821; 14.2325; 12.542
90; 106.365; 90
1795.29Alexis D. C. Parenty; Louise V. Smith; Alexandra L. Pickering; De-Liang Long; Leroy Cronin
General One-Pot, Three-Step Methodology Leading to an Extended Class of N-Heterocyclic Cations: Spontaneous Nucleophilic Addition, Cyclization, and Hydride Loss
Journal of Organic Chemistry, 2004, 69, 5934-5946
4021262 CIFC38 H37 N3 O4P 1 21/c 110.604; 20.826; 14.896
90; 103.04; 90
3204.8Hatem Halouani; Isabelle Dumazet-Bonnamour; Monique Perrin; Roger Lamartine
First Synthesis and Structure of β-Ketoimine Calix[4]arenes: Complexation and Extraction Studies
Journal of Organic Chemistry, 2004, 69, 6521-6527
4021263 CIFC53 H60 Cl2 N4 O4P 1 21/n 116.579; 13.251; 24.292
90; 108.92; 90
5048.6Hatem Halouani; Isabelle Dumazet-Bonnamour; Monique Perrin; Roger Lamartine
First Synthesis and Structure of β-Ketoimine Calix[4]arenes: Complexation and Extraction Studies
Journal of Organic Chemistry, 2004, 69, 6521-6527
4021264 CIFC42 H46 N2 O6P -111.505; 11.831; 13.798
87.57; 81.38; 71.05
1756.3Hatem Halouani; Isabelle Dumazet-Bonnamour; Monique Perrin; Roger Lamartine
First Synthesis and Structure of β-Ketoimine Calix[4]arenes: Complexation and Extraction Studies
Journal of Organic Chemistry, 2004, 69, 6521-6527
4021265 CIFC23 H24 F2 O Si2P -18.626; 9.51; 15.009
85.99; 83.3; 67.9
1132.5Seiichiro Higashiya; Woo Jin Chung; Dong Sung Lim; Silvana C. Ngo; William H. Kelly IV; Paul J. Toscano; John T. Welch
Synthesis of Mono- and Difluoroacetyltrialkylsilanes and the Corresponding Enol Silyl Ethers
Journal of Organic Chemistry, 2004, 69, 6323-6328
4021266 CIFC23 H24 F2 O Si2P -110.164; 14.289; 15.983
77.14; 89.16; 78.98
2220.4Seiichiro Higashiya; Woo Jin Chung; Dong Sung Lim; Silvana C. Ngo; William H. Kelly IV; Paul J. Toscano; John T. Welch
Synthesis of Mono- and Difluoroacetyltrialkylsilanes and the Corresponding Enol Silyl Ethers
Journal of Organic Chemistry, 2004, 69, 6323-6328
4021267 CIFC38 H30 F2 O Si2P -19.253; 9.381; 19.812
82.38; 87.18; 70.74
1609.1Seiichiro Higashiya; Woo Jin Chung; Dong Sung Lim; Silvana C. Ngo; William H. Kelly IV; Paul J. Toscano; John T. Welch
Synthesis of Mono- and Difluoroacetyltrialkylsilanes and the Corresponding Enol Silyl Ethers
Journal of Organic Chemistry, 2004, 69, 6323-6328
4021268 CIFC20 H16 F2 O SiP 1 21/c 17.635; 28.691; 7.983
90; 96.87; 90
1736.2Seiichiro Higashiya; Woo Jin Chung; Dong Sung Lim; Silvana C. Ngo; William H. Kelly IV; Paul J. Toscano; John T. Welch
Synthesis of Mono- and Difluoroacetyltrialkylsilanes and the Corresponding Enol Silyl Ethers
Journal of Organic Chemistry, 2004, 69, 6323-6328

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