Crystallography Open Database

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7110193 CIFC30 H34 N2 O2 Si2P 1 21/c 112.4957; 22.4434; 11.2136
90; 113.21; 90
2890.29Xiaorong Wang; Daniel Fortin; Gessie Brisard; Pierre D. Harvey
Electronic communication across N-linked unconjugated polymers: important insight into the charge transfer processes of polyaniline
Chem.Commun., 2014, 50, 350
7110194 CIFC24 H24 N2 O2 SC 1 2/c 120.925; 11.0264; 18.65
90; 92.884; 90
4297.6Dinesh Pratapsinh Chauhan; Sreejith Jayasree Varma; Arjun Vijeta; Pallavi Banerjee; Pinaki Talukdar
A 1,3-amino group migration route to form acrylamidines
Chem.Commun., 2014, 50, 323
7110195 CIFC29 H32 N2 O4 SP 1 21 19.7934; 11.215; 12.187
90; 96.377; 90
1330.3Dinesh Pratapsinh Chauhan; Sreejith Jayasree Varma; Arjun Vijeta; Pallavi Banerjee; Pinaki Talukdar
A 1,3-amino group migration route to form acrylamidines
Chem.Commun., 2014, 50, 323
7110196 CIFC14 H18 N2 O3 SP 1 21/n 18.266; 25.831; 13.5551
90; 97.899; 90
2866.8Dinesh Pratapsinh Chauhan; Sreejith Jayasree Varma; Arjun Vijeta; Pallavi Banerjee; Pinaki Talukdar
A 1,3-amino group migration route to form acrylamidines
Chem.Commun., 2014, 50, 323
7110197 CIFC21 H26 N2 O3 SP -19.0234; 9.3284; 12.4285
76.805; 86.796; 74.132
979.7Dinesh Pratapsinh Chauhan; Sreejith Jayasree Varma; Arjun Vijeta; Pallavi Banerjee; Pinaki Talukdar
A 1,3-amino group migration route to form acrylamidines
Chem.Commun., 2014, 50, 323
7110198 CIFC43.18 H37.25 Cl2.86 F12 N8 O0.94 P2 RuP -117.115; 17.367; 17.373
81.255; 89.146; 72.459
4863.9Erin Wachter; Brock S. Howerton; Emily C. Hall; Sean Parkin; Edith C. Glazer
A new type of DNA 'light-switch': a dual photochemical sensor and metalating agent for duplex and G-quadruplex DNA
Chem.Commun., 2014, 50, 311
7110199 CIFC40.89 H31.78 Cl1.78 F12 N8 P2 RuP 1 21/c 114.5892; 38.7805; 15.4066
90; 102.636; 90
8505.6Erin Wachter; Brock S. Howerton; Emily C. Hall; Sean Parkin; Edith C. Glazer
A new type of DNA 'light-switch': a dual photochemical sensor and metalating agent for duplex and G-quadruplex DNA
Chem.Commun., 2014, 50, 311
7110200 CIFC8 H28 Al2 B7 In N6 O16I 41/a c d :216.107; 16.107; 19.012
90; 90; 90
4932Lin Cheng; Guo-Yu Yang
A novel aluminoborate open-framework [In(dien)2][Al2B7O16H2] with large chiral cavities templated by chiral main group metal complexes
Chem.Commun., 2014, 50, 344
7110201 CIFC41 H48 Cl2 Cu2 N6 O16P -110.807; 11.252; 20.073
76.82; 75.42; 85.76
2299.7Constance Bochot; Aurelie Gouron; Luigi Bubacco; Anne Milet; Christian Philouze; Marius Reglier; Guy Serratrice; Helene Jamet; Catherine Belle
Probing kojic acid binding to tyrosinase enzyme: insights from a model complex and QM/MM calculations
Chem.Commun., 2014, 50, 308
7110202 CIFC27 H48 N9 O19.5P 1 21 114.434; 14.233; 17.487
90; 92.21; 90
3589.84Atchutarao Pathigoolla; Kana M. Sureshan
Reverse-CD mimics with flexible linkages offer adaptable cavity sizes for guest encapsulation
Chem.Commun., 2014, 50, 317
7110203 CIFC21 H29 Al Br NP -19.5329; 11.3713; 11.5117
99.77; 110.985; 111.068
1021.5Jillian A. Hatnean; Jordan W. Thomson; Preston A. Chase; Douglas W. Stephan
Imine hydrogenation by alkylaluminum catalysts
Chem.Commun., 2014, 50, 301
7110204 CIFC15 H14 O2R -3 :H25.2302; 25.2302; 10.3026
90; 90; 120
5679.6Kazuhiro Hata; Zhiheng He; Constantin Gabriel Daniliuc; Kenichiro Itami; Armido Studer
Synthesis of dihydrobenzo[b]furans by diastereoselective acyloxyarylation
Chem.Commun., 2014, 50, 463
7110205 CIFC20 H22 O3P 1 21/c 112.9968; 13.4352; 10.0076
90; 101.394; 90
1713.03Kazuhiro Hata; Zhiheng He; Constantin Gabriel Daniliuc; Kenichiro Itami; Armido Studer
Synthesis of dihydrobenzo[b]furans by diastereoselective acyloxyarylation
Chem.Commun., 2014, 50, 463
7110206 CIFC14 H16 N2 O4P 1 21 111.863; 4.8437; 12.6119
90; 116.802; 90
646.84M. Su; Maria Tomas-Gamasa; S. Serdjukow; P. Mayer; T. Carell
Synthesis and properties of a Cu(II) complexing pyrazole ligandoside in DNA
Chem.Commun., 2014, 50, 409
7110207 CIFC16 H21 Br O4P 1 21/n 18.3184; 10.279; 19.396
90; 99.917; 90
1633.7Yu Peng; Xiao-Bo Xu; Jian Xiao; Ya-Wen Wang
Nickel-mediated stereocontrolled synthesis of spiroketals via tandem cyclization-coupling of beta-bromo ketals and aryl iodides
Chem.Commun., 2014, 50, 472
7110208 CIFC23 H28 O5P -16.143; 8.81; 19.64
83.8; 83.37; 76.77
1024Yu Peng; Xiao-Bo Xu; Jian Xiao; Ya-Wen Wang
Nickel-mediated stereocontrolled synthesis of spiroketals via tandem cyclization-coupling of beta-bromo ketals and aryl iodides
Chem.Commun., 2014, 50, 472
7110209 CIFC21 H24 O5 SP 1 21/c 111.215; 9.284; 19.41
90; 90.341; 90
2021Yu Peng; Xiao-Bo Xu; Jian Xiao; Ya-Wen Wang
Nickel-mediated stereocontrolled synthesis of spiroketals via tandem cyclization-coupling of beta-bromo ketals and aryl iodides
Chem.Commun., 2014, 50, 472
7110210 CIFC21 H24 O5 SP 1 21/c 111.137; 9.246; 18.976
90; 90.813; 90
1954Yu Peng; Xiao-Bo Xu; Jian Xiao; Ya-Wen Wang
Nickel-mediated stereocontrolled synthesis of spiroketals via tandem cyclization-coupling of beta-bromo ketals and aryl iodides
Chem.Commun., 2014, 50, 472
7110211 CIFC16 H20 I2 O2P 1 21/c 18.616; 22.68; 18.209
90; 96.02; 90
3539Yu Peng; Xiao-Bo Xu; Jian Xiao; Ya-Wen Wang
Nickel-mediated stereocontrolled synthesis of spiroketals via tandem cyclization-coupling of beta-bromo ketals and aryl iodides
Chem.Commun., 2014, 50, 472
7110212 CIFC66 H152 N24 Sc6P 1 21/c 118.0667; 19.2883; 28.4424
90; 125.387; 90
8080.4Peng Cui; Thomas P. Spaniol; Laurent Maron; Jun Okuda
An ion pair scandium hydride supported by a dianionic (NNNN)-type macrocycle ligand
Chem.Commun., 2014, 50, 424
7110213 CIFC22 H50 N8 Sc2P 1 21/c 114.1746; 11.2268; 17.1826
90; 90.8428; 90
2734.1Peng Cui; Thomas P. Spaniol; Laurent Maron; Jun Okuda
An ion pair scandium hydride supported by a dianionic (NNNN)-type macrocycle ligand
Chem.Commun., 2014, 50, 424
7110214 CIFC120 H243 N36 O3 S3 Sc9P 6319.2442; 19.2442; 21.4089
90; 90; 120
6866.3Peng Cui; Thomas P. Spaniol; Laurent Maron; Jun Okuda
An ion pair scandium hydride supported by a dianionic (NNNN)-type macrocycle ligand
Chem.Commun., 2014, 50, 424
7110215 CIFC28 H24 N2 O4 ZnP -110.2881; 11.0671; 11.2031
88.609; 70.855; 79.324
1183.3Anjana Chanthapally; Wei Ting Oh; Jagadese J. Vittal
Photoreactivity of polymorphs of a ladder polymer with criss-cross and parallel orientations of C[double bond, length as m-dash]C bonds
Chem.Commun., 2014, 50, 451
7110216 CIFC28 H24 N2 O4 ZnC 1 2/c 115.6758; 13.6884; 22.957
90; 102.617; 90
4807.1Anjana Chanthapally; Wei Ting Oh; Jagadese J. Vittal
Photoreactivity of polymorphs of a ladder polymer with criss-cross and parallel orientations of C[double bond, length as m-dash]C bonds
Chem.Commun., 2014, 50, 451
7110217 CIFC22 H19 N O4 ZnP -18.2441; 11.3889; 11.8203
67.142; 72.808; 77.218
969.8Anjana Chanthapally; Wei Ting Oh; Jagadese J. Vittal
Photoreactivity of polymorphs of a ladder polymer with criss-cross and parallel orientations of C[double bond, length as m-dash]C bonds
Chem.Commun., 2014, 50, 451
7110218 CIFC28 H24 N2 O4 ZnP -110.208; 10.368; 11.703
87.864; 74.045; 81.843
1178.8Anjana Chanthapally; Wei Ting Oh; Jagadese J. Vittal
Photoreactivity of polymorphs of a ladder polymer with criss-cross and parallel orientations of C[double bond, length as m-dash]C bonds
Chem.Commun., 2014, 50, 451
7110219 CIFC37 H49 Ge N13P 1 21/c 118.2975; 15.668; 15.2402
90; 114.497; 90
3975.8Yun Xiong; Shenglai Yao; Matthias Driess
Synthesis and structure of the azidogermyliumylidene azide complex [L(N3)Ge:]^+^N3^-^ with covalently and ionically bonded azide ligands at germanium(II) [L = bis(N-heterocyclic carbene)]
Chem.Commun., 2014, 50, 418
7110220 CIFC58 H64.5 B Cl Ge N5.5P 1 21/c 114.1255; 12.1448; 31.202
90; 91.799; 90
5350.1Yun Xiong; Shenglai Yao; Matthias Driess
Synthesis and structure of the azidogermyliumylidene azide complex [L(N3)Ge:]^+^N3^-^ with covalently and ionically bonded azide ligands at germanium(II) [L = bis(N-heterocyclic carbene)]
Chem.Commun., 2014, 50, 418
7110221 CIFC57 H63 B Ge N8P 1 21/c 114.1299; 12.315; 30.9315
90; 91.667; 90
5380.1Yun Xiong; Shenglai Yao; Matthias Driess
Synthesis and structure of the azidogermyliumylidene azide complex [L(N3)Ge:]^+^N3^-^ with covalently and ionically bonded azide ligands at germanium(II) [L = bis(N-heterocyclic carbene)]
Chem.Commun., 2014, 50, 418
7110222 CIFC60 H2 OP a -314.0669; 14.0669; 14.0669
90; 90; 90
2783.53Shinobu Aoyagi; Norihisa Hoshino; Tomoyuki Akutagawa; Yuki Sado; Ryo Kitaura; Hisanori Shinohara; Kunihisa Sugimoto; Rui Zhang; Yasujiro Murata
A cubic dipole lattice of water molecules trapped inside carbon cages
Chem.Commun., 2014, 50, 524
7110223 CIFC20 H22 O4P 21 21 218.0638; 12.312; 17.2952
90; 90; 90
1717.09Anne Miersch; Klaus Harms; Gerhard Hilt
Zinc-mediated addition of diethyl bromomalonate to alkynes for the cascade reaction towards polysubstituted pyranones and tetracarbonyl derivatives
Chem.Commun., 2014, 50, 542
7110224 CIFC18 H20 O4P 1 21/c 110.724; 16.7441; 9.1552
90; 104.301; 90
1593Anne Miersch; Klaus Harms; Gerhard Hilt
Zinc-mediated addition of diethyl bromomalonate to alkynes for the cascade reaction towards polysubstituted pyranones and tetracarbonyl derivatives
Chem.Commun., 2014, 50, 542
7110225 CIFC16 H16 O4P -18.056; 9.6155; 9.8824
95.471; 104.231; 111.323
676.61Anne Miersch; Klaus Harms; Gerhard Hilt
Zinc-mediated addition of diethyl bromomalonate to alkynes for the cascade reaction towards polysubstituted pyranones and tetracarbonyl derivatives
Chem.Commun., 2014, 50, 542
7110226 CIFC54.5 H45.5 B Ir N5 O0.75P 1 21/n 19.5427; 13.247; 35.237
90; 93.01; 90
4448.2Dongxin Ma; Lian Duan; Yongge Wei; Lei He; Liduo Wang; Yong Qiu
Increased phosphorescent quantum yields of cationic iridium(III) complexes by wisely controlling the counter anions
Chem.Commun., 2014, 50, 530
7110227 CIFC60 H42 B F12 Ir N6P -112.88; 13.731; 17.199
77.2; 85.04; 63.44
2652.8Dongxin Ma; Lian Duan; Yongge Wei; Lei He; Liduo Wang; Yong Qiu
Increased phosphorescent quantum yields of cationic iridium(III) complexes by wisely controlling the counter anions
Chem.Commun., 2014, 50, 530
7110228 CIFC34 H40 N4 O2P -15.2943; 9.7777; 14.786
107.491; 90.824; 93.038
728.63Wan Yue; Tao He; Matthias Stolte; Marcel Gsanger; Frank Wurthner
Cyanated isoindigos for n-type and ambipolar organic thin film transistors
Chem.Commun., 2014, 50, 545
7110229 CIFC159 H255 Cu6 N3 O63 S36P 4/m n c30.988; 30.988; 45.964
90; 90; 90
44137Yabo Xie; Hui Yang; Zhiyong U. Wang; Yangyang Liu; Hong-Cai Zhou; Jian-Rong Li
Unusual preservation of polyhedral molecular building units in a metal-organic framework with evident desymmetrization in ligand design
Chem.Commun., 2014, 50, 563
7110230 CIFC156 H168 Cu4 N16 O32P -116.1715; 16.307; 17.978
79.131; 71.732; 86.363
4421.2Yabo Xie; Hui Yang; Zhiyong U. Wang; Yangyang Liu; Hong-Cai Zhou; Jian-Rong Li
Unusual preservation of polyhedral molecular building units in a metal-organic framework with evident desymmetrization in ligand design
Chem.Commun., 2014, 50, 563
7110231 CIFC25 H34 N2 O4 SP 1 21 111.7222; 8.40571; 12.7175
90; 101.724; 90
1226.96Pierre-Loic Jacquemin; Koen Robeyns; Michel Devillers; Yann Garcia
Reversible photochromism of an N-salicylidene aniline anion
Chem.Commun., 2014, 50, 649
7110232 CIFC25 H24 F3 O4 P SP 1 21 15.6851; 16.633; 13.304
90; 99.518; 90
1240.7Junzhu Lu; Jinxing Ye; Wei-Liang Duan
Palladium-catalyzed asymmetric 1,6-addition of diarylphosphines to alpha,beta,gamma,delta-unsaturated sulfonic esters: controlling regioselectivity by rational selection of electron-withdrawing groups
Chem.Commun., 2014, 50, 698
7110233 CIFC28 H14 N2 O14 TbC 1 2/c 128.287; 6.8971; 30.2116
90; 99.585; 90
5811.9Yuanjing Cui; Wenfeng Zou; Ruijing Song; Jiancan Yu; Wenqian Zhang; Yu Yang; Guodong Qian
A ratiometric and colorimetric luminescent thermometer over a wide temperature range based on a lanthanide coordination polymer
Chem.Commun., 2014, 50, 719
7110234 CIFC27 H20 Cl2 Hg N4P -19.2217; 10.8168; 13.0876
75.035; 69.904; 83.819
1184.2Biswa Nath Ghosh; Sandip Bhowmik; Prasenjit Mal; Kari Rissanen
A highly selective, Hg2+ triggered hydrogelation: modulation of morphology by chemical stimuli
Chem.Commun., 2014, 50, 734
7110235 CIFC30 H44 Cl2 Fe N6 O10P 21 21 2114.9833; 15.0663; 15.8285
90; 90; 90
3573.2Olga V. Makhlynets; Williamson N. Oloo; Yurii S. Moroz; Irina G. Belaya; Taryn D. Palluccio; Alexander S. Filatov; Peter Muller; Matthew A. Cranswick; Lawrence Que; Elena V. Rybak-Akimova
H2O2 activation with biomimetic non-haem iron complexes and AcOH: connecting the g = 2.7 EPR signal with a visible chromophore
Chem.Commun., 2014, 50, 645
7110236 CIFC26 H40 Cl2 Fe N6 O10F d d 221.9192; 15.582; 19.0923
90; 90; 90
6520.9Olga V. Makhlynets; Williamson N. Oloo; Yurii S. Moroz; Irina G. Belaya; Taryn D. Palluccio; Alexander S. Filatov; Peter Muller; Matthew A. Cranswick; Lawrence Que; Elena V. Rybak-Akimova
H2O2 activation with biomimetic non-haem iron complexes and AcOH: connecting the g = 2.7 EPR signal with a visible chromophore
Chem.Commun., 2014, 50, 645
7110237 CIFC140 H226 Cl12 Fe6 N28 O69.2C 1 2/c 128.316; 27.21; 25.335
90; 104.156; 90
18927Olga V. Makhlynets; Williamson N. Oloo; Yurii S. Moroz; Irina G. Belaya; Taryn D. Palluccio; Alexander S. Filatov; Peter Muller; Matthew A. Cranswick; Lawrence Que; Elena V. Rybak-Akimova
H2O2 activation with biomimetic non-haem iron complexes and AcOH: connecting the g = 2.7 EPR signal with a visible chromophore
Chem.Commun., 2014, 50, 645
7110238 CIFC56 H84 Cl4 Fe2 N10 O22P 21 21 2113.8725; 18.435; 26.781
90; 90; 90
6849Olga V. Makhlynets; Williamson N. Oloo; Yurii S. Moroz; Irina G. Belaya; Taryn D. Palluccio; Alexander S. Filatov; Peter Muller; Matthew A. Cranswick; Lawrence Que; Elena V. Rybak-Akimova
H2O2 activation with biomimetic non-haem iron complexes and AcOH: connecting the g = 2.7 EPR signal with a visible chromophore
Chem.Commun., 2014, 50, 645
7110239 CIFC53 H41 B F24 Ir N3P -112.1985; 14.5752; 16.913
102.455; 108.834; 99.854
2683.11James E. Wheatley; C. Andre Ohlin; Adrian B. Chaplin
Solvent promoted reversible cyclometalation in a tethered NHC iridium complex
Chem.Commun., 2014, 50, 685
7110240 CIFC67 H51 B F24 Ir N3P -112.84071; 13.68282; 19.1287
73.1727; 79.4153; 85.7285
3161.4James E. Wheatley; C. Andre Ohlin; Adrian B. Chaplin
Solvent promoted reversible cyclometalation in a tethered NHC iridium complex
Chem.Commun., 2014, 50, 685
7110241 CIFC53 H41 B F24 N3 RhP -112.1608; 14.5984; 16.9119
102.423; 108.559; 99.8392
2685.08James E. Wheatley; C. Andre Ohlin; Adrian B. Chaplin
Solvent promoted reversible cyclometalation in a tethered NHC iridium complex
Chem.Commun., 2014, 50, 685
7110242 CIFC21 H16 Br2 O3P 1 21/n 17.8079; 14.4168; 16.8239
90; 99.632; 90
1867.1Peng Wang; Saihu Liao; Jian-Bo Zhu; Yong Tang
Double gamma-alkylation of allylic phosphorus ylides: a unique access to oxa-bicyclic[3.3.0] diene skeletons
Chem.Commun., 2014, 50, 808

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