Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1554475 | CIF | C21 H19 F6 N O6 S3 | P 1 21/n 1 | 13.0371; 14.5605; 14.0643 90; 113.617; 90 | 2446.2 | Almendros, Pedro; Yanai, Hikaru; Hoshikawa, Shoki; Aragoncillo, Cristina; Lázaro-Milla, Carlos; Toledano-Pinedo, Mireia; Matsumoto, Takashi; Alcaide, Benito Transition metal-free controlled synthesis of bis[(trifluoromethyl)sulfonyl]ethyl-decorated heterocycles Organic Chemistry Frontiers, 2018, 5, 3163 |
| 1554476 | CIF | C14 H11 Cl F6 N2 O5 S2 | C 1 2/c 1 | 31.442; 7.7594; 16.3435 90; 91.74; 90 | 3985.5 | Almendros, Pedro; Yanai, Hikaru; Hoshikawa, Shoki; Aragoncillo, Cristina; Lázaro-Milla, Carlos; Toledano-Pinedo, Mireia; Matsumoto, Takashi; Alcaide, Benito Transition metal-free controlled synthesis of bis[(trifluoromethyl)sulfonyl]ethyl-decorated heterocycles Organic Chemistry Frontiers, 2018, 5, 3163 |
| 1554477 | CIF | C13 H8 F6 O7 S2 | P 1 21/n 1 | 5.7308; 13.6484; 21.184 90; 95.748; 90 | 1648.6 | Almendros, Pedro; Yanai, Hikaru; Hoshikawa, Shoki; Aragoncillo, Cristina; Lázaro-Milla, Carlos; Toledano-Pinedo, Mireia; Matsumoto, Takashi; Alcaide, Benito Transition metal-free controlled synthesis of bis[(trifluoromethyl)sulfonyl]ethyl-decorated heterocycles Organic Chemistry Frontiers, 2018, 5, 3163 |
| 1554478 | CIF | C13 H10 F6 N2 O4 S2 | P 1 21/c 1 | 14.266; 6.0883; 18.922 90; 94.123; 90 | 1639.2 | Almendros, Pedro; Yanai, Hikaru; Hoshikawa, Shoki; Aragoncillo, Cristina; Lázaro-Milla, Carlos; Toledano-Pinedo, Mireia; Matsumoto, Takashi; Alcaide, Benito Transition metal-free controlled synthesis of bis[(trifluoromethyl)sulfonyl]ethyl-decorated heterocycles Organic Chemistry Frontiers, 2018, 5, 3163 |
| 1554479 | CIF | C9 H10 F6 N2 O5 S2 | P b c a | 17.2641; 14.8304; 23.9088 90; 90; 90 | 6121.5 | Almendros, Pedro; Yanai, Hikaru; Hoshikawa, Shoki; Aragoncillo, Cristina; Lázaro-Milla, Carlos; Toledano-Pinedo, Mireia; Matsumoto, Takashi; Alcaide, Benito Transition metal-free controlled synthesis of bis[(trifluoromethyl)sulfonyl]ethyl-decorated heterocycles Organic Chemistry Frontiers, 2018, 5, 3163 |
| 1554480 | CIF | C15 H14 F6 N2 O5 S2 | P n a 21 | 27.2048; 18.3507; 12.2694 90; 90; 90 | 6125.2 | Almendros, Pedro; Yanai, Hikaru; Hoshikawa, Shoki; Aragoncillo, Cristina; Lázaro-Milla, Carlos; Toledano-Pinedo, Mireia; Matsumoto, Takashi; Alcaide, Benito Transition metal-free controlled synthesis of bis[(trifluoromethyl)sulfonyl]ethyl-decorated heterocycles Organic Chemistry Frontiers, 2018, 5, 3163 |
| 1554481 | CIF | C29 H28 N2 O S2 | P 1 21/n 1 | 17.607; 5.4871; 25.7682 90; 106.169; 90 | 2391 | Weldeab, Asmerom O.; Li, Lei; Cekli, Seda; Abboud, Khalil A.; Schanze, Kirk S.; Castellano, Ronald K. Pyridine-terminated low gap π-conjugated oligomers: design, synthesis, and photophysical response to protonation and metalation Organic Chemistry Frontiers, 2018, 5, 3170 |
| 1554482 | CIF | C26 H22 Br N O9 | P 1 21/c 1 | 11.2685; 18.6581; 12.8795 90; 111.426; 90 | 2520.8 | Agafonova, Anastasiya V.; Smetanin, Ilia A.; Rostovskii, Nikolai V.; Khlebnikov, Alexander F.; Novikov, Mikhail S. Expedient synthesis of 3-hydroxypyrroles via Bu3SnH-triggered ionic 5-exo-trig-cyclization of 5-chloro-3-azamuconoate derivatives Organic Chemistry Frontiers, 2018, 5, 3396 |
| 1554483 | CIF | C16 H9 Cl F3 N O3 S | I b a 2 | 15.569; 29.973; 7.0564 90; 90; 90 | 3292.9 | Yi, Ruxia; Li, Xincheng; Wan, Boshun Ring-opening and cyclization of aziridines with aryl azides: metal-free synthesis of 6-(triflyloxy)quinolines Organic Chemistry Frontiers, 2018, 5, 3488 |
| 1554484 | CIF | C11 H9 F O2 | P 21 21 21 | 4.9693; 5.8579; 31.3863 90; 90; 90 | 913.64 | Han, Sang Hoon; Pandey, Ashok Kumar; Lee, Heeyoung; Kim, Saegun; Kang, Dahye; Jung, Young Hoon; Kim, Hyung Sik; Hong, Sungwoo; Kim, In Su One-pot synthesis of 2-naphthols from nitrones and MBH adducts via decarboxylative N–O bond cleavage Organic Chemistry Frontiers, 2018, 5, 3210 |
| 1554486 | CIF | C14 H8 N3 O | P 1 21/n 1 | 5.7918; 13.738; 13.4519 90; 101.436; 90 | 1049.09 | Li, Ping-Gui; Yan, Cheng; Zhu, Shuai; Liu, Shu-Hui; Zou, Liang-Hua Direct construction of benzimidazo[l,2-c]quinazolin-6-ones via metal-free oxidative C‒C bond cleavage Organic Chemistry Frontiers, 2018, 5, 3464 |
| 1554487 | CIF | C37 H31 N3 O4 S | P 1 21 1 | 13.6363; 8.5322; 15.2209 90; 116.205; 90 | 1588.9 | Gu, Bo-Qi; Yang, Wu-Lin; Wu, Shu-Xiao; Wang, Yan-Bing; Deng, Wei-Ping Organocatalytic asymmetric synthesis of tetrahydrocarbazoles via an inverse-electron-demand Diels–Alder reaction of 2,3-indole-dienes with enals Organic Chemistry Frontiers, 2018, 5, 3430 |
| 1554488 | CIF | C17 H18 N O5 P | P -1 | 9.5039; 10.0075; 10.6869 64.045; 69.351; 83.294 | 854.35 | Wang, Jie; Li, Jun; Wei, Yuanyuan; Yang, Jingya; Huo, Congde Copper-catalyzed oxidative phosphonation of 3,4-dihydro-1,4-benzoxazin-2-ones Organic Chemistry Frontiers, 2018, 5, 3534 |
| 1556101 | CIF | C52 H48 N4 O3 | P -1 | 9.935; 15.483; 15.666 66.557; 76.89; 77.978 | 2134.4 | McCarthy, Jason R.; Jenkins, Hilary A.; Brückner, Christian Free base meso-tetraaryl-morpholinochlorins and porpholactone from meso-tetraaryl-2,3-dihydroxy-chlorin. Organic letters, 2003, 5, 19-22 |
| 1556102 | CIF | C19 H18 I N O4 | P 21 21 21 | 9.2879; 9.8237; 19.8438 90; 90; 90 | 1810.6 | Li, Guigen; Xu, Xin; Chen, Dianjun; Timmons, Cody; Carducci, Michael D.; Headley, Allan D. Asymmetric halo aldol reaction (AHA). Organic letters, 2003, 5, 329-331 |
| 1556103 | CIF | C68 H92 Se10 | P -1 | 10.459; 12.983; 13.711 101.621; 96.648; 94.94 | 1799.9 | Pietschnig, Rudolf; Schäfer, Sven; Merz, Klaus Self-addition of a sterically hindered alkynylselenolate. Organic letters, 2003, 5, 1867-1869 |
| 1556104 | CIF | C19 H19 N O3 S | P 1 21/c 1 | 11.0472; 7.6308; 19.6869 90; 92.423; 90 | 1658.1 | Magnus, Philip; Matthews, Kenneth S.; Lynch, Vince New strategy for the synthesis of tetrahydroisoquinoline alkaloids. Organic letters, 2003, 5, 2181-2184 |
| 1556105 | CIF | C13 H14 N2 O3 | P 21 21 21 | 7.572; 10.031; 15.754 90; 90; 90 | 1196.59 | Magnus, Philip; Matthews, Kenneth S.; Lynch, Vince New strategy for the synthesis of tetrahydroisoquinoline alkaloids. Organic letters, 2003, 5, 2181-2184 |
| 1556106 | CIF | C28 H16 F6 O2 | C c c 2 | 19.3494; 20.3274; 22.3761 90; 90; 90 | 8801 | Brizius, Glen; Billingsley, Kelvin; Smith, Mark D.; Bunz, Uwe H. F. Conformational and electronic engineering of twisted diphenylacetylenes. Organic letters, 2003, 5, 3951-3954 |
| 1556107 | CIF | C27 H40 O Si2 Sn | P 1 c 1 | 11.8381; 11.6026; 22.301 90; 104.522; 90 | 2965.2 | Simpkins, Simon M. E.; Kariuki, Benson M.; Aricó, Caterina S; Cox, Liam R. Stereoselective synthesis of beta-(chloro)vinylsilanes using a regio- and (E)-stereoselective bis-stannylation of unsymmetrically substituted butadiynes: application to the synthesis of a masked triyne. Organic letters, 2003, 5, 3971-3974 |
| 1556108 | CIF | C24.6 H32.8 Cl O1.3 Si2 | I 41/a :2 | 33.3269; 33.3269; 9.8038 90; 90; 90 | 10888.9 | Simpkins, Simon M. E.; Kariuki, Benson M.; Aricó, Caterina S; Cox, Liam R. Stereoselective synthesis of beta-(chloro)vinylsilanes using a regio- and (E)-stereoselective bis-stannylation of unsymmetrically substituted butadiynes: application to the synthesis of a masked triyne. Organic letters, 2003, 5, 3971-3974 |
| 1556486 | CIF | C104 H112 F48 K8 N8 O8 | P 1 21/n 1 | 14.2195; 11.8504; 39.8155 90; 97.526; 90 | 6651.4 | Rosca, S.-C.; Roueindeji, H.; Dorcet, V.; Roisnel, T.; Carpentier, J.-F.; Sarazin, Y. K+...Cpi and K+...F Non-Covalent Interactions in pi-Functionalized Potassium Fluoroalkoxides Inorganics, 2017, 5, 13 |
| 1556487 | CIF | C48 H64 F24 K4 N4 O4 | P -1 | 13.9764; 14.1787; 16.1077 84.831; 81.56; 80.187 | 3104.31 | Rosca, S.-C.; Roueindeji, H.; Dorcet, V.; Roisnel, T.; Carpentier, J.-F.; Sarazin, Y. K+...Cpi and K+...F Non-Covalent Interactions in pi-Functionalized Potassium Fluoroalkoxides Inorganics, 2017, 5, 13 |
| 1556488 | CIF | C12 H16 F6 K N O | P -4 21 c | 13.5114; 13.5114; 17.556 90; 90; 90 | 3205 | Rosca, S.-C.; Roueindeji, H.; Dorcet, V.; Roisnel, T.; Carpentier, J.-F.; Sarazin, Y. K+...Cpi and K+...F Non-Covalent Interactions in pi-Functionalized Potassium Fluoroalkoxides Inorganics, 2017, 5, 13 |
| 1556489 | CIF | C32 H48 F24 K4 N4 O4 | P 1 21/n 1 | 18.9136; 10.774; 24.7556 90; 108.265; 90 | 4790.4 | Rosca, S.-C.; Roueindeji, H.; Dorcet, V.; Roisnel, T.; Carpentier, J.-F.; Sarazin, Y. K+...Cpi and K+...F Non-Covalent Interactions in pi-Functionalized Potassium Fluoroalkoxides Inorganics, 2017, 5, 13 |
| 1556490 | CIF | C26 H70 Be2 Cl2 O2 Si8 | P 1 21/n 1 | 10.3667; 18.8628; 11.387 90; 98.15; 90 | 2204.2 | Naglav, D.; Tobey, B.; Dzialkowski, K.; Jansen, G.; Wolper, C.; Schulz, S. Insights into Molecular Beryllium-Silicon Bonds Inorganics, 2017, 5, 22 |
| 1556491 | CIF | C26 H45 Na O3 Si | P 1 21/c 1 | 8.1123; 14.1264; 24.7662 90; 99.36; 90 | 2800.4 | Seifert, T.; Roesky, P.W. Alkali and Alkaline Earth Metal Complexes Ligated by an Ethynyl Substituted Cyclopentadienyl Ligand Inorganics, 2017, 5, 28 |
| 1556492 | CIF | C22 H37 K O2 Si | P 21 21 21 | 10.287; 11.429; 20.495 90; 90; 90 | 2409.6 | Seifert, T.; Roesky, P.W. Alkali and Alkaline Earth Metal Complexes Ligated by an Ethynyl Substituted Cyclopentadienyl Ligand Inorganics, 2017, 5, 28 |
| 1556493 | CIF | C44 H74 Ca2 I2 O4 Si2 | P 1 21/n 1 | 9.4746; 14.9924; 21.7467 90; 101.49; 90 | 3027.1 | Seifert, T.; Roesky, P.W. Alkali and Alkaline Earth Metal Complexes Ligated by an Ethynyl Substituted Cyclopentadienyl Ligand Inorganics, 2017, 5, 28 |
| 1556494 | CIF | C53 H64 Mg N2 P2 | P 1 21/c 1 | 18.7343; 11.6636; 23.279 90; 106.937; 90 | 4866 | Sindlinger, C.P.; Lawrence, S.R.; Cordes, D.B.; Slawin, A.M.Z.; Stasch, A. Methanediide Formation via Hydrogen Elimination in Magnesium versus Aluminium Hydride Complexes of a Sterically Demanding Bis(iminophosphoranyl)methanediide Inorganics, 2017, 5, 29 |
| 1556495 | CIF | C122 H132 Mg2 N4 P4 | C 1 2/c 1 | 20.547; 22.5; 22 90; 90.34; 90 | 10171 | Sindlinger, C.P.; Lawrence, S.R.; Cordes, D.B.; Slawin, A.M.Z.; Stasch, A. Methanediide Formation via Hydrogen Elimination in Magnesium versus Aluminium Hydride Complexes of a Sterically Demanding Bis(iminophosphoranyl)methanediide Inorganics, 2017, 5, 29 |
| 1556496 | CIF | C49 H57 Al N2 P2 | P 1 21/c 1 | 13.149; 18.972; 17.427 90; 99.58; 90 | 4286.8 | Sindlinger, C.P.; Lawrence, S.R.; Cordes, D.B.; Slawin, A.M.Z.; Stasch, A. Methanediide Formation via Hydrogen Elimination in Magnesium versus Aluminium Hydride Complexes of a Sterically Demanding Bis(iminophosphoranyl)methanediide Inorganics, 2017, 5, 29 |
| 1556497 | CIF | C134 H144 Mg2 N4 P4 | C 1 2/c 1 | 19.08; 34.382; 16.79 90; 90.56; 90 | 11014 | Sindlinger, C.P.; Lawrence, S.R.; Cordes, D.B.; Slawin, A.M.Z.; Stasch, A. Methanediide Formation via Hydrogen Elimination in Magnesium versus Aluminium Hydride Complexes of a Sterically Demanding Bis(iminophosphoranyl)methanediide Inorganics, 2017, 5, 29 |
| 1556498 | CIF | C114 H140 Mg2 N4 O4 P4 | P -1 | 13.51; 14.4; 29.43 100.84; 100.81; 100.62 | 5379 | Sindlinger, C.P.; Lawrence, S.R.; Cordes, D.B.; Slawin, A.M.Z.; Stasch, A. Methanediide Formation via Hydrogen Elimination in Magnesium versus Aluminium Hydride Complexes of a Sterically Demanding Bis(iminophosphoranyl)methanediide Inorganics, 2017, 5, 29 |
| 1556499 | CIF | C17 H25 N O | P c c n | 12.3641; 16.3858; 15.4945 90; 90; 90 | 3139.1 | Gietz, T.; Boere, R.T. Backbone-Substituted beta-Ketoimines and Ketoiminate Clusters: Transoid Li2O2 Squares and D2-Symmetric Li4O4 Cubanes. Synthesis, Crystallography and DFT Calculations Inorganics, 2017, 5, 30 |
| 1556500 | CIF | C14 H19 N O | P 1 21/n 1 | 10.0068; 9.8961; 12.7933 90; 99.138; 90 | 1250.82 | Gietz, T.; Boere, R.T. Backbone-Substituted beta-Ketoimines and Ketoiminate Clusters: Transoid Li2O2 Squares and D2-Symmetric Li4O4 Cubanes. Synthesis, Crystallography and DFT Calculations Inorganics, 2017, 5, 30 |
| 1556501 | CIF | C18 H27 N O | P 21 21 21 | 6.7423; 13.9706; 18.0631 90; 90; 90 | 1701.44 | Gietz, T.; Boere, R.T. Backbone-Substituted beta-Ketoimines and Ketoiminate Clusters: Transoid Li2O2 Squares and D2-Symmetric Li4O4 Cubanes. Synthesis, Crystallography and DFT Calculations Inorganics, 2017, 5, 30 |
| 1556502 | CIF | C15 H21 N O | C 1 2/c 1 | 18.8762; 8.0097; 19.0037 90; 107.543; 90 | 2739.6 | Gietz, T.; Boere, R.T. Backbone-Substituted beta-Ketoimines and Ketoiminate Clusters: Transoid Li2O2 Squares and D2-Symmetric Li4O4 Cubanes. Synthesis, Crystallography and DFT Calculations Inorganics, 2017, 5, 30 |
| 1556503 | CIF | C42 H64 Li2 N2 O4 | P -1 | 9.406; 10.7931; 11.9959 69.04; 73.616; 67.016 | 1032.5 | Gietz, T.; Boere, R.T. Backbone-Substituted beta-Ketoimines and Ketoiminate Clusters: Transoid Li2O2 Squares and D2-Symmetric Li4O4 Cubanes. Synthesis, Crystallography and DFT Calculations Inorganics, 2017, 5, 30 |
| 1556504 | CIF | C36 H52 Li2 N2 O4 | P 1 21/c 1 | 8.0148; 15.0628; 14.5918 90; 103.855; 90 | 1710.35 | Gietz, T.; Boere, R.T. Backbone-Substituted beta-Ketoimines and Ketoiminate Clusters: Transoid Li2O2 Squares and D2-Symmetric Li4O4 Cubanes. Synthesis, Crystallography and DFT Calculations Inorganics, 2017, 5, 30 |
| 1556505 | CIF | C44 H68 Li2 N2 O4 | P 1 21/n 1 | 20.843; 10.495; 21.365 90; 112.886; 90 | 4305.6 | Gietz, T.; Boere, R.T. Backbone-Substituted beta-Ketoimines and Ketoiminate Clusters: Transoid Li2O2 Squares and D2-Symmetric Li4O4 Cubanes. Synthesis, Crystallography and DFT Calculations Inorganics, 2017, 5, 30 |
| 1556506 | CIF | C63 H80 Li4 N4 O4 | P 21 21 21 | 13.753; 18.3062; 24.0904 90; 90; 90 | 6065.1 | Gietz, T.; Boere, R.T. Backbone-Substituted beta-Ketoimines and Ketoiminate Clusters: Transoid Li2O2 Squares and D2-Symmetric Li4O4 Cubanes. Synthesis, Crystallography and DFT Calculations Inorganics, 2017, 5, 30 |
| 1556507 | CIF | C72 H104 Li4 N4 O4 | P 1 21/n 1 | 14.3398; 27.504; 19.8735 90; 107.487; 90 | 7475.9 | Gietz, T.; Boere, R.T. Backbone-Substituted beta-Ketoimines and Ketoiminate Clusters: Transoid Li2O2 Squares and D2-Symmetric Li4O4 Cubanes. Synthesis, Crystallography and DFT Calculations Inorganics, 2017, 5, 30 |
| 1556508 | CIF | C60 H80 Li4 N4 O4 | P 1 21/n 1 | 13.0543; 26.647; 16.4965 90; 91.218; 90 | 5737.1 | Gietz, T.; Boere, R.T. Backbone-Substituted beta-Ketoimines and Ketoiminate Clusters: Transoid Li2O2 Squares and D2-Symmetric Li4O4 Cubanes. Synthesis, Crystallography and DFT Calculations Inorganics, 2017, 5, 30 |
| 1556509 | CIF | C49 H62 I Mg N3 O | P 1 21/n 1 | 8.9827; 23.6098; 22.1855 90; 90.818; 90 | 4704.62 | Vindus, D.; Niemeyer, M. Hetero- and Homoleptic Magnesium Triazenides Inorganics, 2017, 5, 33 |
| 1556510 | CIF | C48 H52 I Mg N3 O | P 1 21/c 1 | 19.848; 9.373; 23.033 90; 90.386; 90 | 4284.9 | Vindus, D.; Niemeyer, M. Hetero- and Homoleptic Magnesium Triazenides Inorganics, 2017, 5, 33 |
| 1556511 | CIF | C90 H104 I4 Mg3 N6 | P b c a | 20.4142; 22.2202; 39.3523 90; 90; 90 | 17850.5 | Vindus, D.; Niemeyer, M. Hetero- and Homoleptic Magnesium Triazenides Inorganics, 2017, 5, 33 |
| 1556512 | CIF | C88 H84 I4 Mg3 N6 | P -1 | 16.9933; 17.5771; 17.8005 93.427; 99.534; 109.991 | 4888.5 | Vindus, D.; Niemeyer, M. Hetero- and Homoleptic Magnesium Triazenides Inorganics, 2017, 5, 33 |
| 1556513 | CIF | C47.5 H50 Mg0.5 N3 | P 1 2/n 1 | 15.0589; 13.0937; 20.3232 90; 99.013; 90 | 3957.8 | Vindus, D.; Niemeyer, M. Hetero- and Homoleptic Magnesium Triazenides Inorganics, 2017, 5, 33 |
| 1556514 | CIF | C81.5 H84 Mg N6 | P 1 21/n 1 | 13.302; 21.531; 24.332 90; 101.877; 90 | 6819.6 | Vindus, D.; Niemeyer, M. Hetero- and Homoleptic Magnesium Triazenides Inorganics, 2017, 5, 33 |
| 1556515 | CIF | C11 H27 Li O Si2 | P 1 21/n 1 | 9.493; 9.9165; 16.7191 90; 92.527; 90 | 1572.4 | Von Pilgrim, M.; Mondeshki, M.; Klett, J. [Bis(Trimethylsilyl)Methyl]Lithium and -Sodium: Solubility in Alkanes and Complexes with O- and N- Donor Ligands Inorganics, 2017, 5, 39 |
| 1556516 | CIF | C13 H35 Li N2 Si2 | P 1 21/c 1 | 18.7636; 13.2303; 17.7299 90; 112.04; 90 | 4079.8 | Von Pilgrim, M.; Mondeshki, M.; Klett, J. [Bis(Trimethylsilyl)Methyl]Lithium and -Sodium: Solubility in Alkanes and Complexes with O- and N- Donor Ligands Inorganics, 2017, 5, 39 |
| 1556517 | CIF | C11 H27 Na O Si2 | P 1 21/n 1 | 11.347; 9.7379; 14.622 90; 90.876; 90 | 1615.5 | Von Pilgrim, M.; Mondeshki, M.; Klett, J. [Bis(Trimethylsilyl)Methyl]Lithium and -Sodium: Solubility in Alkanes and Complexes with O- and N- Donor Ligands Inorganics, 2017, 5, 39 |
| 1556518 | CIF | C32 H86 N6 Na2 Si4 | P 1 21/n 1 | 10.45; 17.414; 14.258 90; 100.824; 90 | 2548.5 | Von Pilgrim, M.; Mondeshki, M.; Klett, J. [Bis(Trimethylsilyl)Methyl]Lithium and -Sodium: Solubility in Alkanes and Complexes with O- and N- Donor Ligands Inorganics, 2017, 5, 39 |
| 1556519 | CIF | C40 H22 Fe N8 Ni O2 S4 | P -1 | 11.5777; 13.6154; 13.9687 66.134; 84.758; 65.272 | 1821 | Takahashi, K.; Sakurai, T.; Zhang, W.-M.; Okubo, S.; Ohta, H.; Yamamoto, T.; Einaga, Y.; Mori, H. Spin-Singlet Transition in the Magnetic Hybrid Compound from a Spin-Crossover Fe(III) Cation and pi-Radical Anion Inorganics, 2017, 5, 54 |
| 1556520 | CIF | C40 H22 Fe N8 Ni O2 S4 | P -1 | 11.4218; 13.7207; 13.8041 67.123; 84.938; 65.324 | 1804 | Takahashi, K.; Sakurai, T.; Zhang, W.-M.; Okubo, S.; Ohta, H.; Yamamoto, T.; Einaga, Y.; Mori, H. Spin-Singlet Transition in the Magnetic Hybrid Compound from a Spin-Crossover Fe(III) Cation and pi-Radical Anion Inorganics, 2017, 5, 54 |
| 1556521 | CIF | C40 H22 Fe N8 Ni O2 S4 | P -1 | 11.7638; 13.5893; 14.1 65.962; 85.184; 65.815 | 1868.6 | Takahashi, K.; Sakurai, T.; Zhang, W.-M.; Okubo, S.; Ohta, H.; Yamamoto, T.; Einaga, Y.; Mori, H. Spin-Singlet Transition in the Magnetic Hybrid Compound from a Spin-Crossover Fe(III) Cation and pi-Radical Anion Inorganics, 2017, 5, 54 |
| 1556522 | CIF | C20 H19 Au Cl N3 O2 | P -1 | 9.3874; 9.8339; 12.0913 69.669; 70.888; 76.465 | 979.82 | Lanoe, P.-H.; Najjari, B.; Hallez, F.; Gontard, G.; Amouri, H. N-Heterocyclic Carbene Coinage Metal Complexes Containing Naphthalimide Chromophore: Design, Structure, and Photophysical Properties Inorganics, 2017, 5, 58 |
| 1556523 | CIF | C76 H78 F12 Mn4 N8 O12 P2 | P -1 | 11.388; 11.8845; 15.3829 75.0794; 75.9749; 84.3937 | 1950.38 | Sukhikh, T.S.; Vostrikova, K.E. Assembly of Mn(III) Schiff Base Complexes with Heptacyanorhenate (IV) Inorganics, 2017, 5, 59 |
| 1556524 | CIF | C67 H64 Mn2 N11 O18 P Re | P -1 | 14.2002; 15.7993; 18.047 84.638; 82.694; 65.057 | 3637.9 | Sukhikh, T.S.; Vostrikova, K.E. Assembly of Mn(III) Schiff Base Complexes with Heptacyanorhenate (IV) Inorganics, 2017, 5, 59 |
| 1556525 | CIF | C237 H224 Cl2 F6 Mn12 N45 O30 P Re3 | P -1 | 13.813; 15.0609; 30.1361 94.447; 93.223; 94.144 | 6222.1 | Sukhikh, T.S.; Vostrikova, K.E. Assembly of Mn(III) Schiff Base Complexes with Heptacyanorhenate (IV) Inorganics, 2017, 5, 59 |
| 1556526 | CIF | C133 H160 F12 Mn6 N19 O20 P2 Re | P 1 21/n 1 | 23.738; 20.5122; 29.8804 90; 93.37; 90 | 14524.2 | Sukhikh, T.S.; Vostrikova, K.E. Assembly of Mn(III) Schiff Base Complexes with Heptacyanorhenate (IV) Inorganics, 2017, 5, 59 |
| 1556527 | CIF | C96 H100 B2 Mn2 N10 O11 | P 1 21/c 1 | 15.9891; 27.544; 21.779 90; 108.762; 90 | 9081.9 | Sukhikh, T.S.; Vostrikova, K.E. Assembly of Mn(III) Schiff Base Complexes with Heptacyanorhenate (IV) Inorganics, 2017, 5, 59 |
| 1556528 | CIF | C24 H28.5 B2 F8 Fe N10.5 P S | P 21 21 21 | 11.3421; 15.3291; 36.7355 90; 90; 90 | 6387 | Stock, P.; Wiedemann, D.; Petzold, H.; Horner, G. Structural Dynamics of Spin Crossover in Iron(II) Complexes with Extended-Tripod Ligands Inorganics, 2017, 5, 60 |
| 1556529 | CIF | C24 H28.5 Cl2 N10.5 O8 P S Zn | P 1 21/c 1 | 9.0934; 31.653; 16.281 90; 136.39; 90 | 3232.3 | Stock, P.; Wiedemann, D.; Petzold, H.; Horner, G. Structural Dynamics of Spin Crossover in Iron(II) Complexes with Extended-Tripod Ligands Inorganics, 2017, 5, 60 |
| 1556530 | CIF | C50 H32 Fe N6 S2 | I b a m | 9.602; 18.9796; 23.8123 90; 90; 90 | 4339.6 | Iwai, S.; Yoshinami, K.; Nakashima, S. Structure and Spin State of Iron(II) Assembled Complexes Using 9,10-Bis(4-pyridyl)anthracene as Bridging Ligand Inorganics, 2017, 5, 61 |
| 1556531 | CIF | C64 H54 B4 F16 Fe2 N20 O3 | P -1 | 13.837; 13.855; 20.684 77.43; 77.58; 86.73 | 3779.5 | Craze, A.R.; Sciortino, N.F.; Badbhade, M.M.; Kepert, C.J.; Marjo, C.E.; Li, F. Investigation of the Spin Crossover Properties of Three Dinulear Fe(II) Triple Helicates by Variation of the Steric Nature of the Ligand Type Inorganics, 2017, 5, 62 |
| 1556532 | CIF | C65 H57 B4 F16 Fe2 N19.5 | C 1 2/c 1 | 21.131; 17.391; 21.069 90; 107; 90 | 7404 | Craze, A.R.; Sciortino, N.F.; Badbhade, M.M.; Kepert, C.J.; Marjo, C.E.; Li, F. Investigation of the Spin Crossover Properties of Three Dinulear Fe(II) Triple Helicates by Variation of the Steric Nature of the Ligand Type Inorganics, 2017, 5, 62 |
| 1556533 | CIF | C64 H54 B4 F15.5 Fe2 N20 S3 | P -1 | 9.521; 16.723; 23.621 95.29; 100.29; 92.93 | 3675.9 | Craze, A.R.; Sciortino, N.F.; Badbhade, M.M.; Kepert, C.J.; Marjo, C.E.; Li, F. Investigation of the Spin Crossover Properties of Three Dinulear Fe(II) Triple Helicates by Variation of the Steric Nature of the Ligand Type Inorganics, 2017, 5, 62 |
| 1556545 | CIF | C10 H22 O5 Si2 | P 1 21/c 1 | 11.5359; 6.7079; 10.1493 90; 115.83; 90 | 706.9 | Kahr, J.; Belaj, F.; Pietschnig, R. Preparation and Molecular Structure of a Cyclopentyl-Substituted Cage Hexasilsesquioxane T6 (T = cyclopentyl-SiO1.5) Starting from the Corresponding Silanetriol Inorganics, 2017, 5, 66 |
| 1556546 | CIF | C10 H22 O5 Si2 | C m c e | 10.1476; 20.7484; 6.7022 90; 90; 90 | 1411.12 | Kahr, J.; Belaj, F.; Pietschnig, R. Preparation and Molecular Structure of a Cyclopentyl-Substituted Cage Hexasilsesquioxane T6 (T = cyclopentyl-SiO1.5) Starting from the Corresponding Silanetriol Inorganics, 2017, 5, 66 |
| 1556547 | CIF | C30 H54 O9 Si6 | C c c a :2 | 16.2855; 22.346; 19.6563 90; 90; 90 | 7153.2 | Kahr, J.; Belaj, F.; Pietschnig, R. Preparation and Molecular Structure of a Cyclopentyl-Substituted Cage Hexasilsesquioxane T6 (T = cyclopentyl-SiO1.5) Starting from the Corresponding Silanetriol Inorganics, 2017, 5, 66 |
| 1556548 | CIF | C69 H45 Cl2 F18 N3 P4 Ru | C 1 2/c 1 | 21.594; 27.753; 23.938 90; 93.631; 90 | 14317 | Van de Watering, F.F.; Heijtbrink, N.; Van der Vlugt, J.I.; Dzik, W.I.; De Bruin, B.; Reek, J.N.H. 3-Methylindole-Based Tripodal Tetraphosphine Ruthenium Complexes in N2 Coordination and Reduction and Formic Acid Dehydrogenation Inorganics, 2017, 5, 73 |
| 1556549 | CIF | C69 H45 F18 N5 P4 Ru | P 1 21/c 1 | 14.2851; 18.909; 29.8721 90; 97.011; 90 | 8008.6 | Van de Watering, F.F.; Heijtbrink, N.; Van der Vlugt, J.I.; Dzik, W.I.; De Bruin, B.; Reek, J.N.H. 3-Methylindole-Based Tripodal Tetraphosphine Ruthenium Complexes in N2 Coordination and Reduction and Formic Acid Dehydrogenation Inorganics, 2017, 5, 73 |
| 1556550 | CIF | C65 H55 Cl6 N3 P4 Ru | P 1 21/n 1 | 19.1879; 18.1604; 19.7879 90; 91.012; 90 | 6894.2 | Van de Watering, F.F.; Heijtbrink, N.; Van der Vlugt, J.I.; Dzik, W.I.; De Bruin, B.; Reek, J.N.H. 3-Methylindole-Based Tripodal Tetraphosphine Ruthenium Complexes in N2 Coordination and Reduction and Formic Acid Dehydrogenation Inorganics, 2017, 5, 73 |
| 1556551 | CIF | C41 H39 I Ni P3 | P n a 21 | 20.526; 10.367; 17.0858 90; 90; 90 | 3635.7 | Iffland, L.; Petuker, A.; Van Gastel, M.; Apfel, U.-P. Mechanistic Implications for the Ni(I)-Catalyzed Kumada Cross-Coupling Reaction Inorganics, 2017, 5, 78 |
| 1556552 | CIF | C31.5 H27 O2.5 | P -1 | 10.337; 10.816; 12.119 72.216; 84.13; 69.554 | 1208.9 | Nguyen, H.N.; Tashima, N.; Ikariya, T.; Kuwata, S. Ruthenium-Catalyzed Dimerization of 1,1-Diphenylpropargyl Alcohol to a Hydroxybenzocyclobutene and Related Reactions Inorganics, 2017, 5, 80 |
| 1556553 | CIF | C55 H50 O3 Ru | P 1 21/c 1 | 17.089; 12.512; 20.001 90; 107.378; 90 | 4081.4 | Nguyen, H.N.; Tashima, N.; Ikariya, T.; Kuwata, S. Ruthenium-Catalyzed Dimerization of 1,1-Diphenylpropargyl Alcohol to a Hydroxybenzocyclobutene and Related Reactions Inorganics, 2017, 5, 80 |
| 1556554 | CIF | C38 H78 N4 Pd4 Si3 | P 1 21/n 1 | 10.8179; 22.0783; 22.8654 90; 92.1391; 90 | 5457.4 | Sunada, Y.; Taniyama, N.; Shimamoto, K.; Kyushin, S.; Nagashima, H. Construction of a Planar Tetrapalladium Cluster by the Reaction of Palladium(0) Bis(isocyanide) with Cyclic Tetrasilane Inorganics, 2017, 5, 84 |
| 1556555 | CIF | C51 H100 N6 Pd4 Si3 | P -1 | 14.505; 15.339; 15.655 89.593; 63.724; 81.301 | 3080.2 | Sunada, Y.; Taniyama, N.; Shimamoto, K.; Kyushin, S.; Nagashima, H. Construction of a Planar Tetrapalladium Cluster by the Reaction of Palladium(0) Bis(isocyanide) with Cyclic Tetrasilane Inorganics, 2017, 5, 84 |
| 1556556 | CIF | C36 H75 O9 P3 Pd3 Si3 | P -1 | 11.2891; 12.711; 19.549 81.516; 85.854; 64.096 | 2495.6 | Sunada, Y.; Taniyama, N.; Shimamoto, K.; Kyushin, S.; Nagashima, H. Construction of a Planar Tetrapalladium Cluster by the Reaction of Palladium(0) Bis(isocyanide) with Cyclic Tetrasilane Inorganics, 2017, 5, 84 |
| 1556557 | CIF | C13 H28 Cl2 N4 Zn | P 21 21 21 | 13.4778; 15.173; 17.57 90; 90; 90 | 3593 | Metz, A.; Heck, J.; Gohlke, C.M.; Krockert, K.; Louven, Y.; McKeown, P.; Hoffmann, A.; Jones, M.D.; Herres-Pawlis, S. Reactivity of Zinc Halide Complexes Containing Camphor-Derived Guanidine Ligands with Technical rac-Lactide Inorganics, 2017, 5, 85 |
| 1556558 | CIF | C13 H26 Cl2 N4 Zn | P 1 21 1 | 9.4718; 18.095; 10.1331 90; 103.908; 90 | 1685.8 | Metz, A.; Heck, J.; Gohlke, C.M.; Krockert, K.; Louven, Y.; McKeown, P.; Hoffmann, A.; Jones, M.D.; Herres-Pawlis, S. Reactivity of Zinc Halide Complexes Containing Camphor-Derived Guanidine Ligands with Technical rac-Lactide Inorganics, 2017, 5, 85 |
| 1556559 | CIF | C13 H26 Br2 N4 Zn | P 1 21 1 | 9.2972; 14.257; 13.2 90; 101.844; 90 | 1712.4 | Metz, A.; Heck, J.; Gohlke, C.M.; Krockert, K.; Louven, Y.; McKeown, P.; Hoffmann, A.; Jones, M.D.; Herres-Pawlis, S. Reactivity of Zinc Halide Complexes Containing Camphor-Derived Guanidine Ligands with Technical rac-Lactide Inorganics, 2017, 5, 85 |
| 1556756 | CIF | Ni Se5 Ta2 | C m c m | 3.5029; 12.8699; 15.6768 90; 90; 90 | 706.74 | Nakano, Akitoshi; Sugawara, Kento; Tamura, Shinya; Katayama, Naoyuki; Matsubayashi, Kazuyuki; Okada, Taku; Uwatoko, Yoshiya; Munakata, Kouji; Nakao, Akiko; Sagayama, Hajime; Kumai, Reiji; Sugimoto, Kunihisa; Maejima, Naoyuki; Machida, Akihiko; Watanuki, Tetsu; Sawa, Hiroshi Pressure-induced coherent sliding-layer transition in the excitonic insulator Ta<sub>2</sub>NiSe<sub>5</sub>. IUCrJ, 2018, 5, 158-165 |
| 1556757 | CIF | Ni Se5 Ta2 | C m c m | 3.4375; 12.375; 15.4437 90; 90; 90 | 656.96 | Nakano, Akitoshi; Sugawara, Kento; Tamura, Shinya; Katayama, Naoyuki; Matsubayashi, Kazuyuki; Okada, Taku; Uwatoko, Yoshiya; Munakata, Kouji; Nakao, Akiko; Sagayama, Hajime; Kumai, Reiji; Sugimoto, Kunihisa; Maejima, Naoyuki; Machida, Akihiko; Watanuki, Tetsu; Sawa, Hiroshi Pressure-induced coherent sliding-layer transition in the excitonic insulator Ta<sub>2</sub>NiSe<sub>5</sub>. IUCrJ, 2018, 5, 158-165 |
| 1556758 | CIF | Ni Se5 Ta2 | P m n m :2 | 3.437; 5.861; 15.512 90; 90; 90 | 312.48 | Nakano, Akitoshi; Sugawara, Kento; Tamura, Shinya; Katayama, Naoyuki; Matsubayashi, Kazuyuki; Okada, Taku; Uwatoko, Yoshiya; Munakata, Kouji; Nakao, Akiko; Sagayama, Hajime; Kumai, Reiji; Sugimoto, Kunihisa; Maejima, Naoyuki; Machida, Akihiko; Watanuki, Tetsu; Sawa, Hiroshi Pressure-induced coherent sliding-layer transition in the excitonic insulator Ta<sub>2</sub>NiSe<sub>5</sub>. IUCrJ, 2018, 5, 158-165 |
| 1556759 | CIF | Ni Se5 Ta2 | P 1 2/n 1 | 3.437; 5.849; 15.512 90; 90.53; 90 | 311.8 | Nakano, Akitoshi; Sugawara, Kento; Tamura, Shinya; Katayama, Naoyuki; Matsubayashi, Kazuyuki; Okada, Taku; Uwatoko, Yoshiya; Munakata, Kouji; Nakao, Akiko; Sagayama, Hajime; Kumai, Reiji; Sugimoto, Kunihisa; Maejima, Naoyuki; Machida, Akihiko; Watanuki, Tetsu; Sawa, Hiroshi Pressure-induced coherent sliding-layer transition in the excitonic insulator Ta<sub>2</sub>NiSe<sub>5</sub>. IUCrJ, 2018, 5, 158-165 |
| 1556829 | CIF | C30 H29 Cl2 Cu2 I2 N O2 S2 | P -1 | 11.7925; 11.9665; 13.4375 93.29; 95.681; 118.683 | 1643.38 | Park, In-Hyeok; Kang, Yunji; Lee, Eunji; Ju, Huiyeong; Kim, Seulgi; Seo, Sujin; Jung, Jong Hwa; Lee, Shim Sung Snapshot and crystallographic observations of kinetic and thermodynamic products for NO<sub>2</sub>S<sub>2</sub> macrocyclic complexes. IUCrJ, 2018, 5, 45-53 |
| 1556830 | CIF | C29 H27 Cd2 I4 N O2 S2 | C 1 2/c 1 | 23.3017; 13.4569; 26.9935 90; 102.963; 90 | 8248.6 | Park, In-Hyeok; Kang, Yunji; Lee, Eunji; Ju, Huiyeong; Kim, Seulgi; Seo, Sujin; Jung, Jong Hwa; Lee, Shim Sung Snapshot and crystallographic observations of kinetic and thermodynamic products for NO<sub>2</sub>S<sub>2</sub> macrocyclic complexes. IUCrJ, 2018, 5, 45-53 |
| 1556831 | CIF | C58 H54 Cd4 I8 N2 O4 S4 | P -1 | 11.66; 12.147; 12.585 75.142; 87.056; 86.996 | 1719.2 | Park, In-Hyeok; Kang, Yunji; Lee, Eunji; Ju, Huiyeong; Kim, Seulgi; Seo, Sujin; Jung, Jong Hwa; Lee, Shim Sung Snapshot and crystallographic observations of kinetic and thermodynamic products for NO<sub>2</sub>S<sub>2</sub> macrocyclic complexes. IUCrJ, 2018, 5, 45-53 |
| 1556832 | CIF | C116 H106 Cd8 I16 N4 O8 S8 | P -1 | 11.3166; 13.4404; 24.586 86.655; 89.396; 78.371 | 3656.5 | Park, In-Hyeok; Kang, Yunji; Lee, Eunji; Ju, Huiyeong; Kim, Seulgi; Seo, Sujin; Jung, Jong Hwa; Lee, Shim Sung Snapshot and crystallographic observations of kinetic and thermodynamic products for NO<sub>2</sub>S<sub>2</sub> macrocyclic complexes. IUCrJ, 2018, 5, 45-53 |
| 1556833 | CIF | C29 H27 Cd Cu I3 N O2 S2 | P -1 | 8.9645; 14.4098; 14.8826 65.853; 73.386; 81.546 | 1680.04 | Park, In-Hyeok; Kang, Yunji; Lee, Eunji; Ju, Huiyeong; Kim, Seulgi; Seo, Sujin; Jung, Jong Hwa; Lee, Shim Sung Snapshot and crystallographic observations of kinetic and thermodynamic products for NO<sub>2</sub>S<sub>2</sub> macrocyclic complexes. IUCrJ, 2018, 5, 45-53 |
| 1556834 | CIF | C0.26 Na0.01 O2 Si | F d -3 m :2 | 19.442; 19.442; 19.442 90; 90; 90 | 7348.9 | Scheidl, K. S.; Effenberger, H. S.; Yagi, T.; Momma, K.; Miletich, Ronald The hydrocarbon-bearing clathrasil chibaite and its host-guest structure at low temperature. IUCrJ, 2018, 5, 595-607 |
| 1556835 | CIF | C0.26 Na0.01 O2 Si | F d -3 m :2 | 19.4214; 19.4214; 19.4214 90; 90; 90 | 7325.6 | Scheidl, K. S.; Effenberger, H. S.; Yagi, T.; Momma, K.; Miletich, Ronald The hydrocarbon-bearing clathrasil chibaite and its host-guest structure at low temperature. IUCrJ, 2018, 5, 595-607 |
| 1556836 | CIF | C0.58 Na0.02 O4.53 Si2.27 | A 1 2/n 1 | 23.7844; 13.732; 23.784 90; 109.47; 90 | 7324 | Scheidl, K. S.; Effenberger, H. S.; Yagi, T.; Momma, K.; Miletich, Ronald The hydrocarbon-bearing clathrasil chibaite and its host-guest structure at low temperature. IUCrJ, 2018, 5, 595-607 |
| 1556837 | CIF | C0.26 Na0.01 O2 Si | F d -3 m :2 | 19.4199; 19.4199; 19.4199 90; 90; 90 | 7323.9 | Scheidl, K. S.; Effenberger, H. S.; Yagi, T.; Momma, K.; Miletich, Ronald The hydrocarbon-bearing clathrasil chibaite and its host-guest structure at low temperature. IUCrJ, 2018, 5, 595-607 |
| 1556838 | CIF | C0.58 Na0.02 O4.53 Si2.27 | A 1 2/n 1 | 23.834; 13.76; 23.833 90; 109.47; 90 | 7369 | Scheidl, K. S.; Effenberger, H. S.; Yagi, T.; Momma, K.; Miletich, Ronald The hydrocarbon-bearing clathrasil chibaite and its host-guest structure at low temperature. IUCrJ, 2018, 5, 595-607 |
| 1556839 | CIF | C0.26 Na0.01 O2 Si | F d -3 m :2 | 19.3944; 19.3944; 19.3944 90; 90; 90 | 7295.1 | Scheidl, K. S.; Effenberger, H. S.; Yagi, T.; Momma, K.; Miletich, Ronald The hydrocarbon-bearing clathrasil chibaite and its host-guest structure at low temperature. IUCrJ, 2018, 5, 595-607 |
| 1556840 | CIF | C0.58 Na0.02 O4.53 Si2.27 | A 1 2/n 1 | 23.834; 13.76; 23.833 90; 109.47; 90 | 7369 | Scheidl, K. S.; Effenberger, H. S.; Yagi, T.; Momma, K.; Miletich, Ronald The hydrocarbon-bearing clathrasil chibaite and its host-guest structure at low temperature. IUCrJ, 2018, 5, 595-607 |
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