Crystallography Open Database

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7117556 CIFC41 H46 Cl2 F6 Ir N2 P3P 1 21/c 117.973; 11.5843; 19.988
90; 99.642; 90
4102.8Iglesias, Manuel; Iturmendi, Amaia; Sanz Miguel, Pablo J.; Polo, Victor; Pérez-Torrente, Jesús J; Oro, Luis A.
Tuning PCP-Ir complexes: the impact of an N-heterocyclic olefin.
Chemical communications (Cambridge, England), 2015, 51, 12431-12434
7117557 CIFC36 H40 Cl6 F6 Ir N2 O P3P 1 21/c 111.5979; 18.5435; 20.1876
90; 104; 90
4212.7Iglesias, Manuel; Iturmendi, Amaia; Sanz Miguel, Pablo J.; Polo, Victor; Pérez-Torrente, Jesús J; Oro, Luis A.
Tuning PCP-Ir complexes: the impact of an N-heterocyclic olefin.
Chemical communications (Cambridge, England), 2015, 51, 12431-12434
7117558 CIFC21 H14 Br F2 NC 1 c 111.1103; 19.8612; 8.6893
90; 119.104; 90
1675.31Wang, Liliang; Kong, Lingbing; Li, Yongxin; Ganguly, Rakesh; Kinjo, Rei
Anti-Markovnikov hydroimination of terminal alkynes in gold-catalyzed pyridine construction from ammonia.
Chemical communications (Cambridge, England), 2015, 51, 12419-12422
7117559 CIFC22 H17 F2 NP -18.758; 9.0189; 12.1251
77.13; 80.995; 74.079
893.19Wang, Liliang; Kong, Lingbing; Li, Yongxin; Ganguly, Rakesh; Kinjo, Rei
Anti-Markovnikov hydroimination of terminal alkynes in gold-catalyzed pyridine construction from ammonia.
Chemical communications (Cambridge, England), 2015, 51, 12419-12422
7117560 CIFC24 H16 Br3 NP -19.84; 13.6565; 15.873
102.909; 93.588; 95.664
2061.1Wang, Liliang; Kong, Lingbing; Li, Yongxin; Ganguly, Rakesh; Kinjo, Rei
Anti-Markovnikov hydroimination of terminal alkynes in gold-catalyzed pyridine construction from ammonia.
Chemical communications (Cambridge, England), 2015, 51, 12419-12422
7117561 CIFC24 H16 F3 NP 111.219; 11.5; 14.861
72.7; 89.67; 77.32
1782.3Wang, Liliang; Kong, Lingbing; Li, Yongxin; Ganguly, Rakesh; Kinjo, Rei
Anti-Markovnikov hydroimination of terminal alkynes in gold-catalyzed pyridine construction from ammonia.
Chemical communications (Cambridge, England), 2015, 51, 12419-12422
7117562 CIFC27 H22 F3 N O2P 1 21/n 117.8858; 5.3984; 24.0688
90; 107.814; 90
2212.5Wang, Liliang; Kong, Lingbing; Li, Yongxin; Ganguly, Rakesh; Kinjo, Rei
Anti-Markovnikov hydroimination of terminal alkynes in gold-catalyzed pyridine construction from ammonia.
Chemical communications (Cambridge, England), 2015, 51, 12419-12422
7117563 CIFC43 H57 Au Cl3 NP 1 21/c 120.7969; 9.1006; 22.4423
90; 104.981; 90
4103.2Wang, Liliang; Kong, Lingbing; Li, Yongxin; Ganguly, Rakesh; Kinjo, Rei
Anti-Markovnikov hydroimination of terminal alkynes in gold-catalyzed pyridine construction from ammonia.
Chemical communications (Cambridge, England), 2015, 51, 12419-12422
7117564 CIFC19 H21 Cl N4 O6P 1 21 19.96; 8.9114; 12.427
90; 105.91; 90
1060.7Xie, Ming-Sheng; Wang, Yong; Li, Jian-Ping; Du, Cong; Zhang, Yan-Yan; Hao, Er-Jun; Zhang, Yi-Ming; Qu, Gui-Rong; Guo, Hai-Ming
A straightforward entry to chiral carbocyclic nucleoside analogues via the enantioselective [3+2] cycloaddition of α-nucleobase substituted acrylates.
Chemical communications (Cambridge, England), 2015, 51, 12451-12454
7117565 CIFC34 H29 F3 N4 O2P -110.748; 11.799; 12.2207
76.828; 73.111; 87.926
1443.17Nicholls-Allison, Emma C; Nawn, Graeme; Patrick, Brian O.; Hicks, Robin G.
Protoisomerization of indigo di- and monoimines.
Chemical communications (Cambridge, England), 2015, 51, 12482-12485
7117566 CIFC32 H29 B F4 N4P 1 21/c 112.7461; 9.883; 22.461
90; 106.476; 90
2713.2Nicholls-Allison, Emma C; Nawn, Graeme; Patrick, Brian O.; Hicks, Robin G.
Protoisomerization of indigo di- and monoimines.
Chemical communications (Cambridge, England), 2015, 51, 12482-12485
7117567 CIFC24 H20 Cl N3 OP -17.956; 9.421; 13.978
107.481; 96.743; 100.43
966.2Nicholls-Allison, Emma C; Nawn, Graeme; Patrick, Brian O.; Hicks, Robin G.
Protoisomerization of indigo di- and monoimines.
Chemical communications (Cambridge, England), 2015, 51, 12482-12485
7117568 CIFC24 H19 N3 OP 1 21/n 114.1344; 14.8496; 17.8584
90; 95.5371; 90
3730.8Nicholls-Allison, Emma C; Nawn, Graeme; Patrick, Brian O.; Hicks, Robin G.
Protoisomerization of indigo di- and monoimines.
Chemical communications (Cambridge, England), 2015, 51, 12482-12485
7117569 CIFC40 H40 Br4 Cl2 Dy F6 N4 O8 P Zn2C 1 2/c 117.1014; 18.2552; 15.9346
90; 97.4595; 90
4932.51Oyarzabal, I.; Ruiz, J.; Ruiz, E.; Aravena, D.; Seco, J. M.; Colacio, E.
Increasing the effective energy barrier promoted by the change of a counteranion in a Zn-Dy-Zn SMM: slow relaxation via the second excited state.
Chemical communications (Cambridge, England), 2015, 51, 12353-12356
7117570 CIFC73.5 H95 Au2 Cl3 F6 N5 O4 SbP 1 21/c 117.2829; 20.6778; 21.9456
90; 90.406; 90
7842.6Gimeno, Ana; Rodríguez-Gimeno, Alejandra; Cuenca, Ana B.; Ramírez de Arellano, Carmen; Medio-Simón, Mercedes; Asensio, Gregorio
Gold(i)-catalysed cascade reactions in the synthesis of 2,3-fused indole derivatives.
Chemical communications (Cambridge, England), 2015, 51, 12384-12387
7117571 CIFC30 H28 Cl2 N4 ZnP n n a14.7556; 22.5021; 10.5208
90; 90; 90
3493.2Martí-Rujas, Javier; Bonafede, Simone; Tushi, Dorearta; Cametti, Massimo
Multiple single-crystal-to-single-crystal guest exchange in a dynamic 1D coordination polymer.
Chemical communications (Cambridge, England), 2015, 51, 12357-12360
7117572 CIFC31 H28 Cl5 N4 ZnP n n a14.6608; 22.7977; 9.9218
90; 90; 90
3316.2Martí-Rujas, Javier; Bonafede, Simone; Tushi, Dorearta; Cametti, Massimo
Multiple single-crystal-to-single-crystal guest exchange in a dynamic 1D coordination polymer.
Chemical communications (Cambridge, England), 2015, 51, 12357-12360
7117573 CIFC62 H60 Cl8 N8 Zn2P n n a14.6639; 22.7525; 9.8535
90; 90; 90
3287.5Martí-Rujas, Javier; Bonafede, Simone; Tushi, Dorearta; Cametti, Massimo
Multiple single-crystal-to-single-crystal guest exchange in a dynamic 1D coordination polymer.
Chemical communications (Cambridge, England), 2015, 51, 12357-12360
7117574 CIFC32 H28 Cl4 N4 ZnP n n a14.7255; 22.4827; 10.2852
90; 90; 90
3405.1Martí-Rujas, Javier; Bonafede, Simone; Tushi, Dorearta; Cametti, Massimo
Multiple single-crystal-to-single-crystal guest exchange in a dynamic 1D coordination polymer.
Chemical communications (Cambridge, England), 2015, 51, 12357-12360
7117575 CIFC30 H28 N4P -15.599; 7.1074; 16.1003
92.646; 98.583; 112.049
583.53Martí-Rujas, Javier; Bonafede, Simone; Tushi, Dorearta; Cametti, Massimo
Multiple single-crystal-to-single-crystal guest exchange in a dynamic 1D coordination polymer.
Chemical communications (Cambridge, England), 2015, 51, 12357-12360
7117576 CIFC22 H22 OP 1 21/c 118.8889; 5.8024; 15.156
90; 95.856; 90
1652.44Vandavasi, Jaya Kishore; Hu, Wan-Ping; Boominathan, Siva Senthil Kumar; Guo, Bing-Chun; Hsiao, Cheng-Tien; Wang, Jeh-Jeng
Au(i)-catalyzed synthesis of 8-oxabicyclo[3.2.1]oct-2-enes and 9-oxabicyclo[3.3.1]nona-2,6-dienes from enynol via oxonium/Prins-type cyclization.
Chemical communications (Cambridge, England), 2015, 51, 12435-12438
7117577 CIFC25 H20 O3P -15.8013; 11.3046; 15.3699
110.966; 92.458; 102.961
908.83Vandavasi, Jaya Kishore; Hu, Wan-Ping; Boominathan, Siva Senthil Kumar; Guo, Bing-Chun; Hsiao, Cheng-Tien; Wang, Jeh-Jeng
Au(i)-catalyzed synthesis of 8-oxabicyclo[3.2.1]oct-2-enes and 9-oxabicyclo[3.3.1]nona-2,6-dienes from enynol via oxonium/Prins-type cyclization.
Chemical communications (Cambridge, England), 2015, 51, 12435-12438
7117578 CIFC20 H20 OP 1 21/n 16.2076; 15.3283; 16.201
90; 95.237; 90
1535.1Vandavasi, Jaya Kishore; Hu, Wan-Ping; Boominathan, Siva Senthil Kumar; Guo, Bing-Chun; Hsiao, Cheng-Tien; Wang, Jeh-Jeng
Au(i)-catalyzed synthesis of 8-oxabicyclo[3.2.1]oct-2-enes and 9-oxabicyclo[3.3.1]nona-2,6-dienes from enynol via oxonium/Prins-type cyclization.
Chemical communications (Cambridge, England), 2015, 51, 12435-12438
7117579 CIFC18 H16 OP 1 21/c 15.5946; 9.1084; 26.337
90; 90.82; 90
1341.94Vandavasi, Jaya Kishore; Hu, Wan-Ping; Boominathan, Siva Senthil Kumar; Guo, Bing-Chun; Hsiao, Cheng-Tien; Wang, Jeh-Jeng
Au(i)-catalyzed synthesis of 8-oxabicyclo[3.2.1]oct-2-enes and 9-oxabicyclo[3.3.1]nona-2,6-dienes from enynol via oxonium/Prins-type cyclization.
Chemical communications (Cambridge, England), 2015, 51, 12435-12438
7117580 CIFC9 H9 B F4 N2P 1 21/a 113.372; 6.2221; 13.8278
90; 112.232; 90
1065Leblanc, Nicolas; Sproules, Stephen; Pasquier, Claude; Auban-Senzier, Pascale; Raffy, Helene; Powell, Annie K.
Approaching the limit of Cu(II)/Cu(I) mixed valency in a Cu(I)Br2-N-methylquinoxalinium hybrid compound.
Chemical communications (Cambridge, England), 2015, 51, 12740-12743
7117581 CIFC9 H9 Br2 Cu N2C 1 2/m 115.373; 6.4099; 10.9646
90; 96.692; 90
1073.1Leblanc, Nicolas; Sproules, Stephen; Pasquier, Claude; Auban-Senzier, Pascale; Raffy, Helene; Powell, Annie K.
Approaching the limit of Cu(II)/Cu(I) mixed valency in a Cu(I)Br2-N-methylquinoxalinium hybrid compound.
Chemical communications (Cambridge, England), 2015, 51, 12740-12743
7117582 CIFC36 H108 N9 Nb9 O69.5 P5P 1 21/c 127.347; 15.4386; 24.5428
90; 91.742; 90
10357.2Son, Jung-Ho; Casey, William H.
A new Keggin-like niobium-phosphate cluster that reacts reversibly with hydrogen peroxide.
Chemical communications (Cambridge, England), 2015, 51, 12744-12747
7117583 CIFC24 H28 N2 O2P 1 21/n 111.8462; 7.6966; 22.1897
90; 94.024; 90
2018.2Rawling, M. J.; Storr, T. E.; Bawazir, W. A.; Cully, S. J.; Lewis, W.; Makki, M. S. I. T.; Strutt, I. R.; Jones, G.; Hamza, D.; Stockman, R. A.
Facile access to a heterocyclic, sp(3)-rich chemical scaffold via a tandem condensation/intramolecular nitrone-alkene [3+2] cycloaddition strategy.
Chemical communications (Cambridge, England), 2015, 51, 12867-12870
7117584 CIFC18 H24 N2 O2P -18.0233; 8.5269; 12.1531
107.964; 98.204; 97.133
770.22Rawling, M. J.; Storr, T. E.; Bawazir, W. A.; Cully, S. J.; Lewis, W.; Makki, M. S. I. T.; Strutt, I. R.; Jones, G.; Hamza, D.; Stockman, R. A.
Facile access to a heterocyclic, sp(3)-rich chemical scaffold via a tandem condensation/intramolecular nitrone-alkene [3+2] cycloaddition strategy.
Chemical communications (Cambridge, England), 2015, 51, 12867-12870
7117585 CIFC20 H21 N O3 SP 1 21/c 110.783; 12.0241; 14.0523
90; 93.965; 90
1817.6Liu, Bang; Song, Ren-Jie; Ouyang, Xuan-Hui; Li, Yang; Hu, Ming; Li, Jin-Heng
Palladium-catalyzed oxidative 6-exo-trig cyclization of 1,6-enynes: facile synthesis of bicyclo[4.1.0]heptan-5-ones.
Chemical communications (Cambridge, England), 2015, 51, 12819-12822
7117586 CIFC73 H67 N2 O PP n a 2118.9194; 14.8964; 20.0103
90; 90; 90
5639.5Liu, Liu; Ruiz, David A.; Dahcheh, Fatme; Bertrand, Guy
Isolation of a Lewis base stabilized parent phosphenium (PH2(+)) and related species.
Chemical communications (Cambridge, England), 2015, 51, 12732-12735
7117587 CIFC88 H72 B F4 N2 PP -113.7202; 16.4329; 19.0854
74.147; 78.554; 81.404
4036.3Liu, Liu; Ruiz, David A.; Dahcheh, Fatme; Bertrand, Guy
Isolation of a Lewis base stabilized parent phosphenium (PH2(+)) and related species.
Chemical communications (Cambridge, England), 2015, 51, 12732-12735
7117588 CIFC71 H58 F6 N2 O7 P S2P -114.4808; 14.6435; 15.4095
83.039; 84.164; 77.715
3159.5Liu, Liu; Ruiz, David A.; Dahcheh, Fatme; Bertrand, Guy
Isolation of a Lewis base stabilized parent phosphenium (PH2(+)) and related species.
Chemical communications (Cambridge, England), 2015, 51, 12732-12735
7117589 CIFC73 H57 Fe N2 O4 PP 1 21/n 112.6626; 18.3247; 25.5405
90; 101.719; 90
5802.8Liu, Liu; Ruiz, David A.; Dahcheh, Fatme; Bertrand, Guy
Isolation of a Lewis base stabilized parent phosphenium (PH2(+)) and related species.
Chemical communications (Cambridge, England), 2015, 51, 12732-12735
7117590 CIFC69 H57 Au2 Cl2 N2 PP 1 21/c 115.4817; 18.0766; 24.4404
90; 98.019; 90
6772.9Liu, Liu; Ruiz, David A.; Dahcheh, Fatme; Bertrand, Guy
Isolation of a Lewis base stabilized parent phosphenium (PH2(+)) and related species.
Chemical communications (Cambridge, England), 2015, 51, 12732-12735
7117591 CIFC69 H63 B2 N2 PP 1 21/c 113.5874; 17.073; 24.447
90; 105.718; 90
5459.1Liu, Liu; Ruiz, David A.; Dahcheh, Fatme; Bertrand, Guy
Isolation of a Lewis base stabilized parent phosphenium (PH2(+)) and related species.
Chemical communications (Cambridge, England), 2015, 51, 12732-12735
7117592 CIFC22 H25 N OP 1 21/c 112.82457; 6.61539; 20.0798
90; 93.3829; 90
1700.59Paterson, Andrew J.; St John-Campbell, Sahra; Mahon, Mary F.; Press, Neil J.; Frost, Christopher G.
Catalytic meta-selective C-H functionalization to construct quaternary carbon centres.
Chemical communications (Cambridge, England), 2015, 51, 12807-12810
7117593 CIFC222 H218 Co12 N26 O50P -117.7558; 21.8506; 21.8517
60.483; 81.896; 68.78
6870Xu, Hong; Wang, Qian; Qin, Jian-Hua; Zang, Shuang-Quan; Langley, Stuart K.; Murray, Keith S.; Moubaraki, Boujemaa; Batten, Stuart R.; Mak, Thomas C. W.
A cyclic dodecanuclear cobalt cluster based on a derivative of the rhodamine 6G dye with unusual magnetization.
Chemical communications (Cambridge, England), 2015, 51, 12716-12719
7117594 CIFC50 H62 Cl4 Cu2 N8 O21 S5P b c a18.0973; 28.4369; 28.5016
90; 90; 90
14667.8Rancan, Marzio; Armelao, Lidia
Exploiting dimensional variability in coordination polymers: solvent promotes reversible conversion between 3D and chiral 1D architectures.
Chemical communications (Cambridge, England), 2015, 51, 12947-12949
7117595 CIFC9 H16 Cl Cu0.5 N O6 S2P 31 2 110.7197; 10.7197; 23.0839
90; 90; 120
2297.2Rancan, Marzio; Armelao, Lidia
Exploiting dimensional variability in coordination polymers: solvent promotes reversible conversion between 3D and chiral 1D architectures.
Chemical communications (Cambridge, England), 2015, 51, 12947-12949
7117596 CIFC9 H16 Cl Cu0.5 N O6 S2P 32 2 110.7314; 10.7314; 23.1419
90; 90; 120
2308.04Rancan, Marzio; Armelao, Lidia
Exploiting dimensional variability in coordination polymers: solvent promotes reversible conversion between 3D and chiral 1D architectures.
Chemical communications (Cambridge, England), 2015, 51, 12947-12949
7117597 CIFC16 H12 O3P 1 21/n 16.0914; 8.5177; 23.947
90; 90.598; 90
1242.4Karad, Somnath Narayan; Chung, Wei-Kang; Liu, Rai-Shung
Gold-catalyzed formal [4π+2π]-cycloadditions of tert-butyl propiolates with aldehydes and ketones to form 4H-1,3-dioxine derivatives.
Chemical communications (Cambridge, England), 2015, 51, 13004-13007
7117598 CIFC21 H18 F N O2C 1 2/c 140.945; 4.8118; 18.994
90; 114.23; 90
3412.5Zhou, Peng; Hao, Wen-Juan; Zhang, Jin-Peng; Jiang, Bo; Li, Guigen; Tu, Shu-Jiang
Cascade bicyclizations of o-alkynyl aldehydes with thiazolium salts: a new access toward poly-functionalized indeno[2,1-b]pyrroles.
Chemical communications (Cambridge, England), 2015, 51, 13012-13015
7117599 CIFC24 H18 Cu N6 O7I 1 2/a 116.6086; 7.1589; 19.141
90; 102.179; 90
2224.6Larragy, Ruth; Fitzgerald, Jenny; Prisecaru, Andreea; McKee, Vickie; Leonard, Paul; Kellett, Andrew
Protein engineering with artificial chemical nucleases.
Chemical communications (Cambridge, England), 2015, 51, 12908-12911
7117600 CIFC41 H56 B2 Cl4 Fe2 N2 O4P 1 21/c 19.156; 10.84; 22.94
90; 100.259; 90
2240Braunschweig, Holger; Ewing, William C.; Ferkinghoff, Katharina; Hermann, Alexander; Kramer, Thomas; Shang, Rong; Siedler, Eva; Werner, Christine
Activation of boryl-, borylene and metalloborylene complexes by isonitriles.
Chemical communications (Cambridge, England), 2015, 51, 13032-13035
7117601 CIFC21 H31 B Mn N3 O2P 1 21/c 19.5331; 12.839; 18.276
90; 97.456; 90
2217.99Braunschweig, Holger; Ewing, William C.; Ferkinghoff, Katharina; Hermann, Alexander; Kramer, Thomas; Shang, Rong; Siedler, Eva; Werner, Christine
Activation of boryl-, borylene and metalloborylene complexes by isonitriles.
Chemical communications (Cambridge, England), 2015, 51, 13032-13035
7117602 CIFC38 H48 B Cr Fe N3 O7P 1 21 110.8; 18.449; 19.691
90; 96.23; 90
3900Braunschweig, Holger; Ewing, William C.; Ferkinghoff, Katharina; Hermann, Alexander; Kramer, Thomas; Shang, Rong; Siedler, Eva; Werner, Christine
Activation of boryl-, borylene and metalloborylene complexes by isonitriles.
Chemical communications (Cambridge, England), 2015, 51, 13032-13035
7117603 CIFC14 H19 Cd N3 O2 SP b c a13.9096; 10.5234; 22.6923
90; 90; 90
3321.61Roy, Sumit; Dey, Arka; Ray, Partha Pratim; Ortega-Castro, Joaquín; Frontera, Antonio; Chattopadhyay, Shouvik
Application of a novel 2D cadmium(ii)-MOF in the formation of a photo-switch with a substantial on-off ratio.
Chemical communications (Cambridge, England), 2015, 51, 12974-12976
7117604 CIFC58 H44 F20 Ir2 N12 O P2P -19.382; 13.771; 14.966
63; 76.75; 82.82
1676.5Li, Guangfu; Ren, Xinyao; Shan, Guogang; Che, Weilong; Zhu, Dongxia; Yan, Likai; Su, Zhongmin; Bryce, Martin R.
New AIE-active dinuclear Ir(iii) complexes with reversible piezochromic phosphorescence behaviour.
Chemical communications (Cambridge, England), 2015, 51, 13036-13039
7117605 CIFC40 H49 Cu N3 O2P 1 21/c 114.9821; 27.9247; 18.0471
90; 107.42; 90
7204.1Doistau, Benjamin; Cantin, Jean-Louis; Chamoreau, Lise-Marie; Marvaud, Valérie; Hasenknopf, Bernold; Vives, Guillaume
Mechanical switching of magnetic interaction by tweezers-type complex.
Chemical communications (Cambridge, England), 2015, 51, 12916-12919

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