Crystallography Open Database

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7238423 CIFC26 H30 Cl2 N6 TiP 21 21 2111.829; 12.517; 18.391
90; 90; 90		2723Zhao, Yang; Lin, Miaoshui; Chen, Zhou; Pei, Hao; Li, Yahong; Chen, Yanmei; Wang, Xiufang; Li, Lei; Cao, Yanyuan; Zhang, Yong; Li, Wu
Titanium and zirconium amido complexes supported by imidazole-containing ligands: syntheses, characterization and catalytic activities
RSC Adv., 2012, 2, 144
7238424 CIFC44 H36 Cl4 N8 TiP -18.9628; 13.517; 19.262
73.96; 87.86; 74.76		2162.3Zhao, Yang; Lin, Miaoshui; Chen, Zhou; Pei, Hao; Li, Yahong; Chen, Yanmei; Wang, Xiufang; Li, Lei; Cao, Yanyuan; Zhang, Yong; Li, Wu
Titanium and zirconium amido complexes supported by imidazole-containing ligands: syntheses, characterization and catalytic activities
RSC Adv., 2012, 2, 144
7238430 CIFC36 H32 O2P n a 2116.5695; 15.0759; 11.296
90; 90; 90		2821.7Zhu, Shugao; Wu, Luling; Huang, Xian
Palladium-catalyzed sequential reaction viaSonogashira coupling, isomerization, Claisen rearrangement and [4 + 2] cycloaddition sequence for the rapid synthesis of tricyclo[3.2.1.02,7]oct-3-ene derivatives
RSC Adv., 2012, 2, 132
7238434 CIFC54 H60 Hf N4 O8C 1 2/c 119.017; 19.507; 15.973
90; 117.708; 90		5245.9Kumar Saha, Tanmoy; Rajashekhar, Bijja; Chakraborty, Debashis
Alkoxides of group 4 metals containing the bis(imino)phenoxide ligand: synthesis, structural characterization and polymerization studies
RSC Adv., 2012, 2, 307
7238435 CIFC70 H90 Cl2 N4 O4 ZrP 1 21/n 112.07; 22.74; 27.72
90; 100.89; 90		7471Kumar Saha, Tanmoy; Rajashekhar, Bijja; Chakraborty, Debashis
Alkoxides of group 4 metals containing the bis(imino)phenoxide ligand: synthesis, structural characterization and polymerization studies
RSC Adv., 2012, 2, 307
7238436 CIFC79 H104 N4 O6 TiP 1 21/c 112.0283; 28.2315; 21.64
90; 98.251; 90		7272.4Kumar Saha, Tanmoy; Rajashekhar, Bijja; Chakraborty, Debashis
Alkoxides of group 4 metals containing the bis(imino)phenoxide ligand: synthesis, structural characterization and polymerization studies
RSC Adv., 2012, 2, 307
7238445 CIFC35 H62 N8 O15P 21 21 2110.798; 15.09; 27.46
90; 90; 90		4474Tian, Jun-Mian; Ou-Yang, Si-Sheng; Zhang, Xu; Di, Ying-Tong; Jiang, Hua-Liang; Li, Hong-Lin; Dai, Wei-Xing; Chen, Ke-Yu; Liu, Mai-Li; Hao, Xiao-Jiang; Shen, Yun-Heng; Luo, Cheng; Zhang, Wei-Dong
Experimental and computational insights into the conformations of tunicyclin E, a new cycloheptapeptide from Psammosilene tunicoides
RSC Adv., 2012, 2, 1126
7238446 CIFC22 H21 N O2P c a b8.5808; 46.211; 8.7745
90; 90; 90		3479.3Kundu, Kshama; Nayak, Sandip K.
(±)-Camphor-10-sulfonic acid catalyzed direct one-pot three-component Mannich type reaction of alkyl (hetero)aryl ketones under solvent-free conditions: application to the synthesis of aminochromans
RSC Adv., 2012, 2, 480
7238447 CIFC21 H20 B F2 I N2 O2P -19.41; 10.603; 11.494
66.655; 83.633; 69.026		982.5Zhu, Shilei; Zhang, Jingtuo; Vegesna, Giri; Tiwari, Ashutosh; Luo, Fen-Tair; Zeller, Matthias; Luck, Rudy; Li, Haihua; Green, Sarah; Liu, Haiying
Controlled Knoevenagel reactions of methyl groups of 1,3,5,7-tetramethyl BODIPY dyes for unique BODIPY dyes
RSC Adv., 2012, 2, 404
7238448 CIFC22 H21 B F2 N2 O3P -16.5685; 8.8104; 16.478
81.757; 84.965; 85.897		938.42Zhu, Shilei; Zhang, Jingtuo; Vegesna, Giri; Tiwari, Ashutosh; Luo, Fen-Tair; Zeller, Matthias; Luck, Rudy; Li, Haihua; Green, Sarah; Liu, Haiying
Controlled Knoevenagel reactions of methyl groups of 1,3,5,7-tetramethyl BODIPY dyes for unique BODIPY dyes
RSC Adv., 2012, 2, 404
7238451 CIFC11 H7 Br N4 SP 1 21/c 14.3849; 23.419; 11.2403
90; 100.743; 90		1134.04Neto, Brenno A. D.; Carvalho, Pedro H. P. R.; Santos, Diego C. B. D.; Gatto, Claudia C.; Ramos, Luciana M.; Vasconcelos, Nathalia M. de; Corrêa, José R.; Costa, Maísa B.; de Oliveira, Heibbe C. B.; Silva, Rafael G.
Synthesis, properties and highly selective mitochondria staining with novel, stable and superior benzothiadiazole fluorescent probes
RSC Adv., 2012, 2, 1524
7238452 CIFC11 H8 N4 SP 1 2/n 122.9294; 3.8241; 23.2133
90; 93.832; 90		2030.89Neto, Brenno A. D.; Carvalho, Pedro H. P. R.; Santos, Diego C. B. D.; Gatto, Claudia C.; Ramos, Luciana M.; Vasconcelos, Nathalia M. de; Corrêa, José R.; Costa, Maísa B.; de Oliveira, Heibbe C. B.; Silva, Rafael G.
Synthesis, properties and highly selective mitochondria staining with novel, stable and superior benzothiadiazole fluorescent probes
RSC Adv., 2012, 2, 1524
7238453 CIFC16 H13 B Br N O2P 1 21 14.32; 10.637; 16.09
90; 94.11; 90		737.5Chopard, Claude; Bertho, Gildas; Prangé, Thierry
Naphthalene-dioxygenase catalysed cis-dihydroxylation of bicyclic azaarenes
RSC Adv., 2012, 2, 605
7238454 CIFC16 H13 B Br N O2P 1 21 112.683; 4.267; 14.339
90; 107.93; 90		738.3Chopard, Claude; Bertho, Gildas; Prangé, Thierry
Naphthalene-dioxygenase catalysed cis-dihydroxylation of bicyclic azaarenes
RSC Adv., 2012, 2, 605
7238455 CIFC22 H14 O2 SP 1 21/c 113.288; 5.6186; 22.5335
90; 93.035; 90		1679.99Coombs, Benjamin A.; Rutter, Simon R.; Goeta, Andrés E.; Sparkes, Hazel A.; Batsanov, Andrei S.; Beeby, Andrew
2,5-bis(Arylethynyl)thienyl systems: Preparation and photophysical properties. Part II
RSC Advances, 2012, 2, 1870
7238456 CIFC20 H12 O2 SP 1 21/c 114.1518; 6.2943; 18.7696
90; 109.741; 90		1573.65Coombs, Benjamin A.; Rutter, Simon R.; Goeta, Andrés E.; Sparkes, Hazel A.; Batsanov, Andrei S.; Beeby, Andrew
2,5-bis(Arylethynyl)thienyl systems: Preparation and photophysical properties. Part II
RSC Advances, 2012, 2, 1870
7238457 CIFC30 H30 O4 SP 1 21/n 116.462; 7.2069; 23.1514
90; 107.172; 90		2624.2Coombs, Benjamin A.; Rutter, Simon R.; Goeta, Andrés E.; Sparkes, Hazel A.; Batsanov, Andrei S.; Beeby, Andrew
2,5-bis(Arylethynyl)thienyl systems: Preparation and photophysical properties. Part II
RSC Advances, 2012, 2, 1870
7238458 CIFC30 H28 S2P -16.0263; 8.1335; 13.0125
87.992; 77.115; 74.072		597.64Coombs, Benjamin A.; Rutter, Simon R.; Goeta, Andrés E.; Sparkes, Hazel A.; Batsanov, Andrei S.; Beeby, Andrew
2,5-bis(Arylethynyl)thienyl systems: Preparation and photophysical properties. Part II
RSC Advances, 2012, 2, 1870
7238459 CIFC30 H28 S2P -16.2158; 7.6037; 13.2115
102.29; 93.687; 97.016		602.91Coombs, Benjamin A.; Rutter, Simon R.; Goeta, Andrés E.; Sparkes, Hazel A.; Batsanov, Andrei S.; Beeby, Andrew
2,5-bis(Arylethynyl)thienyl systems: Preparation and photophysical properties. Part II
RSC Advances, 2012, 2, 1870
7238460 CIFC10 H20 O2 S Si2P m m n :215.2943; 15.4858; 6.421
90; 90; 90		1520.8Coombs, Benjamin A.; Rutter, Simon R.; Goeta, Andrés E.; Sparkes, Hazel A.; Batsanov, Andrei S.; Beeby, Andrew
2,5-bis(Arylethynyl)thienyl systems: Preparation and photophysical properties. Part II
RSC Advances, 2012, 2, 1870
7238461 CIFC18 H72 N9 O48 S12 Sm5C 1 2/c 120.6494; 35.261; 10.1318
90; 115.004; 90		6685.8Zhang, Deng; Zheng, Lei; Qiu, Xinmin; Xu, Yan; Fu, Jie; Zhu, Dunru
Structural systematic design of organic templated samarium sulfates and their luminescence property
RSC Adv., 2012, 2, 217
7238462 CIFC8 H40 N8 O28 S7 Sm2P c a 2121.761; 14.877; 10.4238
90; 90; 90		3374.6Zhang, Deng; Zheng, Lei; Qiu, Xinmin; Xu, Yan; Fu, Jie; Zhu, Dunru
Structural systematic design of organic templated samarium sulfates and their luminescence property
RSC Adv., 2012, 2, 217
7238463 CIFC2 H14 N O14 S3 SmP -19.237; 9.364; 9.557
70.491; 78.215; 79.378		756.7Zhang, Deng; Zheng, Lei; Qiu, Xinmin; Xu, Yan; Fu, Jie; Zhu, Dunru
Structural systematic design of organic templated samarium sulfates and their luminescence property
RSC Adv., 2012, 2, 217
7238464 CIFC6 H24 N3 O12 S3 SmP -19.618; 10.496; 10.535
71.826; 73.584; 76.454		956.7Zhang, Deng; Zheng, Lei; Qiu, Xinmin; Xu, Yan; Fu, Jie; Zhu, Dunru
Structural systematic design of organic templated samarium sulfates and their luminescence property
RSC Adv., 2012, 2, 217
7238465 CIFC22 H39 F3 N O3 P Pd SP 1 21/c 111.227; 8.4499; 27.587
90; 91.82; 90		2615.8Beck, John F.; Schmidt, Joseph A.R.
Hydroamination of 1,1-dimethylallene with primary aryl amines under mild conditions: An atom-economical route to N-(1,1-dimethyl-2-propenyl)-anilines
RSC Adv., 2012, 2, 128
7238466 CIFC35 H36 N4 O2P 1 21/c 110.007; 19.208; 15.433
90; 99.743; 90		2923.7Wu, Jieyun; Liu, Jialei; Zhou, Tingting; Bo, Shuhui; Qiu, Ling; Zhen, Zhen; Liu, Xinhou
Enhanced electro-optic coefficient (r33) in nonlinear optical chromospheres with novel donor structure
RSC Adv., 2012, 2, 1416
7238467 CIFC29 H28 N4 O2P 1 21/n 113.437; 8.1496; 23.189
90; 96.921; 90		2520.8Wu, Jieyun; Liu, Jialei; Zhou, Tingting; Bo, Shuhui; Qiu, Ling; Zhen, Zhen; Liu, Xinhou
Enhanced electro-optic coefficient (r33) in nonlinear optical chromospheres with novel donor structure
RSC Adv., 2012, 2, 1416
7238468 CIFC88 H84 Cl14 P8 PdP 1 21/c 114.942; 18.073; 17.298
90; 93.44; 90		4662.9Fernández-Anca, Damián; García-Seijo, M. Inés; García-Fernández, M. Esther
Transition of trigonal-bipyramidal to square-planar geometries by oxidation of a coordinated tripodal polyphosphine in Pd(ii) and Pt(ii) complexes
RSC Adv., 2012, 2, 1404
7238469 CIFC86 H90 Cl2 O12 P8 PdP -111.808; 13.975; 15.675
105.495; 98.909; 102.948		2365Fernández-Anca, Damián; García-Seijo, M. Inés; García-Fernández, M. Esther
Transition of trigonal-bipyramidal to square-planar geometries by oxidation of a coordinated tripodal polyphosphine in Pd(ii) and Pt(ii) complexes
RSC Adv., 2012, 2, 1404
7238470 CIFC48 H57 Cl O8 P4 Pd S2C 1 2/c 136.211; 14.7523; 20.89
90; 106.565; 90		10696Fernández-Anca, Damián; García-Seijo, M. Inés; García-Fernández, M. Esther
Transition of trigonal-bipyramidal to square-planar geometries by oxidation of a coordinated tripodal polyphosphine in Pd(ii) and Pt(ii) complexes
RSC Adv., 2012, 2, 1404
7238471 CIFC57 H55 Cl2 O4 P3 Ru S2P -110.433; 14.2442; 18.2189
80.194; 84.401; 87.677		2654.43Patel, Payel; Naeem, Saira; White, Andrew J. P.; Wilton-Ely, James D. E. T.
Synthesis and reactivity of dialkyldithiophosphate complexes of ruthenium(ii)
RSC Adv., 2012, 2, 999
7238472 CIFC28 H40 F6 N2 O10 Ru2 S2P -19.337; 12.272; 17.763
99.83; 103.22; 105.48		1850.4Godó, Attila J.; Bényei, Attila Cs.; Duff, Brian; Egan, Denise A.; Buglyó, Péter
Synthesis and X-ray diffraction structures of novel half-sandwich Os(ii)-and Ru(ii)-hydroxamate complexes
RSC Adv., 2012, 2, 1486
7238473 CIFC13 H20 Cl N O2 OsP 1 21/c 116.0879; 10.0754; 17.8788
90; 100.934; 90		2845.4Godó, Attila J.; Bényei, Attila Cs.; Duff, Brian; Egan, Denise A.; Buglyó, Péter
Synthesis and X-ray diffraction structures of novel half-sandwich Os(ii)-and Ru(ii)-hydroxamate complexes
RSC Adv., 2012, 2, 1486
7238474 CIFC23 H24 Cl N O2 RuP c 21 n9.902; 10.38; 21.015
90; 90; 90		2160Godó, Attila J.; Bényei, Attila Cs.; Duff, Brian; Egan, Denise A.; Buglyó, Péter
Synthesis and X-ray diffraction structures of novel half-sandwich Os(ii)-and Ru(ii)-hydroxamate complexes
RSC Adv., 2012, 2, 1486
7238475 CIFC46 H50 F6 N4 O10 Ru2 S2P 1 21/n 117.902; 14.938; 19.641
90; 105.36; 90		5064.8Godó, Attila J.; Bényei, Attila Cs.; Duff, Brian; Egan, Denise A.; Buglyó, Péter
Synthesis and X-ray diffraction structures of novel half-sandwich Os(ii)-and Ru(ii)-hydroxamate complexes
RSC Adv., 2012, 2, 1486
7238476 CIFC29 H29 F3 N2 O5 Ru SP 42 b c17.482; 17.482; 19.478
90; 90; 90		5953Godó, Attila J.; Bényei, Attila Cs.; Duff, Brian; Egan, Denise A.; Buglyó, Péter
Synthesis and X-ray diffraction structures of novel half-sandwich Os(ii)-and Ru(ii)-hydroxamate complexes
RSC Adv., 2012, 2, 1486
7238477 CIFC32 H40 F6 N2 O8 Os2 S2P b c a10.209; 17.512; 21.043
90; 90; 90		3762Godó, Attila J.; Bényei, Attila Cs.; Duff, Brian; Egan, Denise A.; Buglyó, Péter
Synthesis and X-ray diffraction structures of novel half-sandwich Os(ii)-and Ru(ii)-hydroxamate complexes
RSC Adv., 2012, 2, 1486
7238478 CIFC20 H32 F3 N3 O11 Os2 SP 1 21/c 114.2845; 9.4565; 21.8716
90; 105.511; 90		2846.84Godó, Attila J.; Bényei, Attila Cs.; Duff, Brian; Egan, Denise A.; Buglyó, Péter
Synthesis and X-ray diffraction structures of novel half-sandwich Os(ii)-and Ru(ii)-hydroxamate complexes
RSC Adv., 2012, 2, 1486
7238479 CIFC26 H22 Fe N2P -110.345; 10.589; 11.221
67.47; 67.79; 82.84		1050.8López, Concepción; González, Asensio; Bosque, Ramon; Basu, Pradipta K.; Font-Bardía, Mercè; Calvet, Teresa
Platinum(ii) and palladium(ii) complexes derived from 1-ferrocenylmethyl-3,5-diphenylpyrazole. Coordination, cyclometallation or transannulation?
RSC Advances, 2012, 2, 1986
7238480 CIFC28 H28 Cl2 Fe N2 O Pt SP b c a15.865; 13.213; 26.348
90; 90; 90		5523López, Concepción; González, Asensio; Bosque, Ramon; Basu, Pradipta K.; Font-Bardía, Mercè; Calvet, Teresa
Platinum(ii) and palladium(ii) complexes derived from 1-ferrocenylmethyl-3,5-diphenylpyrazole. Coordination, cyclometallation or transannulation?
RSC Advances, 2012, 2, 1986
7238481 CIFC28 H28 Cl2 Fe N2 O Pd SP b c a15.938; 13.226; 26.424
90; 90; 90		5570López, Concepción; González, Asensio; Bosque, Ramon; Basu, Pradipta K.; Font-Bardía, Mercè; Calvet, Teresa
Platinum(ii) and palladium(ii) complexes derived from 1-ferrocenylmethyl-3,5-diphenylpyrazole. Coordination, cyclometallation or transannulation?
RSC Advances, 2012, 2, 1986
7238482 CIFC45 H38 Cl3 Fe N2 P PdP -19.817; 11.219; 19.794
76.47; 82.46; 69.94		1987.9López, Concepción; González, Asensio; Bosque, Ramon; Basu, Pradipta K.; Font-Bardía, Mercè; Calvet, Teresa
Platinum(ii) and palladium(ii) complexes derived from 1-ferrocenylmethyl-3,5-diphenylpyrazole. Coordination, cyclometallation or transannulation?
RSC Advances, 2012, 2, 1986
7238483 CIFC44 H36 Cl Fe N2 P PdP -110.625; 12.789; 14.469
93.58; 105.39; 107.09		1790.7López, Concepción; González, Asensio; Bosque, Ramon; Basu, Pradipta K.; Font-Bardía, Mercè; Calvet, Teresa
Platinum(ii) and palladium(ii) complexes derived from 1-ferrocenylmethyl-3,5-diphenylpyrazole. Coordination, cyclometallation or transannulation?
RSC Advances, 2012, 2, 1986
7238550 CIFC4 H5 I2 N2 SP 1 21/n 18.2469; 11.3129; 10.3137
90; 106.79; 90		921.21Owczarzak, Anita M.; Kubicki, Maciej; Kourkoumelis, Nikolaos; Hadjikakou, Sotiris K.
Stabilization of poly-iodides: structural influences of the cationic disulfides of 2-mercapto-3,4,5,6-tetrahydro-pyrimidine and 2-mercatpo-pyrimidine
RSC Advances, 2012, 2, 2856
7238551 CIFC96 H192 Cl6 I38 N48 S24P n n m20.982; 42.307; 12.4442
90; 90; 90		11046.5Owczarzak, Anita M.; Kubicki, Maciej; Kourkoumelis, Nikolaos; Hadjikakou, Sotiris K.
Stabilization of poly-iodides: structural influences of the cationic disulfides of 2-mercapto-3,4,5,6-tetrahydro-pyrimidine and 2-mercatpo-pyrimidine
RSC Advances, 2012, 2, 2856
7238552 CIFC16 H32 Cl I9 N8 S4P 1 21/c 114.502; 12.31; 12.354
90; 111.59; 90		2050.7Owczarzak, Anita M.; Kubicki, Maciej; Kourkoumelis, Nikolaos; Hadjikakou, Sotiris K.
Stabilization of poly-iodides: structural influences of the cationic disulfides of 2-mercapto-3,4,5,6-tetrahydro-pyrimidine and 2-mercatpo-pyrimidine
RSC Advances, 2012, 2, 2856
7238553 CIFC8 H16 I3 N4 S2P 21 21 212.2118; 25.3633; 5.6918
90; 90; 90		1762.93Owczarzak, Anita M.; Kubicki, Maciej; Kourkoumelis, Nikolaos; Hadjikakou, Sotiris K.
Stabilization of poly-iodides: structural influences of the cationic disulfides of 2-mercapto-3,4,5,6-tetrahydro-pyrimidine and 2-mercatpo-pyrimidine
RSC Advances, 2012, 2, 2856
7238554 CIFC39 H29 N5 OC 1 c 19.7301; 54.938; 5.4824
90; 92.879; 90		2926.9Bhaumik, Chanchal; Maity, Dinesh; Das, Shyamal; Baitalik, Sujoy
Synthesis, structural characterization, solvatochromism, and ion-binding studies of a ditopic receptor based on 2-(4-[2,2′: 6′,2′′]terpyridin-4′-yl-phenyl)-1H-phenanthro[9,10-d] imidazole (tpy-HImzphen) unit
RSC Advances, 2012, 2, 2581
7238555 CIFC52 H40 N10P b c a14.853; 22.747; 25.64
90; 90; 90		8663Takase, Masayoshi; Yoshida, Naofumi; Narita, Tomoyuki; Fujio, Takashi; Nishinaga, Tohru; Iyoda, Masahiko
Sterically congested pyrrole-fused tetrathiafulvalene decamers as highly conductive amorphous molecular materials
RSC Advances, 2012, 2, 3221
7238556 CIFC19 H14 Fe OP n a 2121.5703; 5.9474; 10.9774
90; 90; 90		1408.26Plażuk, Damian; Zakrzewski, Janusz; Nakatani, Keitaro; Makal, Anna; Woźniak, Krzysztof; Domagała, Sławomir
Electronic and molecular structures and bulk second‒order nonlinear optical properties of ferrocenyl ynones
RSC Advances, 2012, 2, 3512

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