Crystallography Open Database
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Searching journal of publication like 'Crystals'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
1508383 | CIF | C35 H27 Cl2 N3 S12 Zn | C 1 2/c 1 | 11.8152; 10.1; 35.579 90; 98.111; 90 | 4203.3 | Nita, Gabriela; Branzea, Diana; Pop, Flavia; El-Ghayoury, Abdelkrim; Avarvari, Narcis Electroactive Bisiminopyridine Ligands: Synthesis and Complexation Studies Crystals, 2012, 2, 338-348 |
1508384 | CIF | C20 H20 B0.5 N O | C 1 2/c 1 | 21.4373; 6.1623; 23.2775 90; 97.597; 90 | 3048 | Bag, Pradip; Itkis, Mikhail E.; Pal, Sushanta K.; Bekyarova, Elena; Donnadieu, Bruno; Haddon, Robert C. Synthesis, Structure and Solid State Properties of Cyclohexanemethylamine Substituted Phenalenyl Based Molecular Conductor Crystals, 2012, 2, 446-465 |
1508394 | CIF | C26 H24 O5 | C 1 2/c 1 | 25.4114; 8.4744; 20.6921 90; 108.328; 90 | 4229.93 | Kaur, Manpreet; Jasinski, Jerry P.; Butcher, Ray J.; Yathirajan, Hemmige S.; Mayekar, Anil N.; Narayana, Badiadka Crystal and Molecular Structure Studies of Ethyl 4-(4-Hydroxyphenyl)-6-(6-methoxy-2-naphthyl)-2-oxocyclohex-3-ene-1-carboxylate and Ethyl 4-(3-Bromophenyl)-6-(6-methoxy-2-naphthyl)-2-oxocyclohex-3-ene-1-carboxylate Crystals, 2012, 2, 1239-1247 |
1508406 | CIF | C H2 Ba O5 P | C 1 2/c 1 | 12.3829; 7.9124; 11.0858 90; 114.788; 90 | 986.1 | Iveson, Samuel J.; Johnston, Chloe B.; Harrison, William T.A. Barium Oxalates Combined with Oxo-Anions and Organic Cations: Syntheses and Structures of Ba2(C2O4)(H2PO3)2 and C2H10N2 Ba(H2O)2(HC2O4)4 Crystals, 2012, 1, 59-68 |
1508430 | CIF | C H3 Ag N6 | C 1 2/c 1 | 18.0338; 3.601; 14.906 90; 91.94; 90 | 967.4 | Laus, Gerhard; Kahlenberg, Volker; Wurst, Klaus; Schottenberger, Herwig; Fischer, Niko; Stierstorfer, Jοrg; Klapοtke, Thomas M. Synthesis and Crystal Structures of New 5,5'-Azotetrazolates Crystals, 2012, 2, 127-136 |
1508445 | CIF | C27 H20 N3 O0.5 S16 | C 1 2/c 1 | 15.7423; 13.2947; 33.81 90; 96.701; 90 | 7027.7 | Benmansour, Samia; Marchivie, Mathieu; Triki, Smail; Gomez-Garcia, Carlos J. Polymorphism and Metallic Behavior in BEDT-TTF Radical Salts with Polycyano Anions Crystals, 2012, 2, 306-326 |
1508446 | CIF | C25 H18 N3 O S16 | C 1 2/c 1 | 15.5152; 13.2644; 33.673 90; 97.443; 90 | 6871.5 | Benmansour, Samia; Marchivie, Mathieu; Triki, Smail; Gomez-Garcia, Carlos J. Polymorphism and Metallic Behavior in BEDT-TTF Radical Salts with Polycyano Anions Crystals, 2012, 2, 306-326 |
1508462 | CIF | C16 H12 Pd2 S20 Sb | C 1 2/c 1 | 14.325; 6.403; 36.893 90; 97.543; 90 | 3355 | Kato, Reizo; Hengbo, Cui Cation Dependence of Crystal Structure and Band Parameters in a Series of Molecular Conductors, beta'-(Cation)[Pd(dmit)2]2 (dmit = 1,3-dithiole-2-thione-4,5-dithiolate) Crystals, 2012, 2, 861-874 |
1508463 | CIF | C16 H12 P Pd2 S20 | C 1 2/c 1 | 14.379; 6.3539; 36.496 90; 98.07; 90 | 3301.4 | Kato, Reizo; Hengbo, Cui Cation Dependence of Crystal Structure and Band Parameters in a Series of Molecular Conductors, beta'-(Cation)[Pd(dmit)2]2 (dmit = 1,3-dithiole-2-thione-4,5-dithiolate) Crystals, 2012, 2, 861-874 |
1508464 | CIF | C16 H12 As Pd2 S20 | C 1 2/c 1 | 14.383; 6.3691; 36.672 90; 97.793; 90 | 3328.4 | Kato, Reizo; Hengbo, Cui Cation Dependence of Crystal Structure and Band Parameters in a Series of Molecular Conductors, beta'-(Cation)[Pd(dmit)2]2 (dmit = 1,3-dithiole-2-thione-4,5-dithiolate) Crystals, 2012, 2, 861-874 |
1508465 | CIF | C17 H14 Pd2 S20 Sb | C 1 2/c 1 | 14.503; 6.3989; 37.244 90; 97.352; 90 | 3427.9 | Kato, Reizo; Hengbo, Cui Cation Dependence of Crystal Structure and Band Parameters in a Series of Molecular Conductors, beta'-(Cation)[Pd(dmit)2]2 (dmit = 1,3-dithiole-2-thione-4,5-dithiolate) Crystals, 2012, 2, 861-874 |
1508466 | CIF | C17 H14 P Pd2 S20 | C 1 2/c 1 | 14.437; 6.3614; 37.243 90; 96.938; 90 | 3395.3 | Kato, Reizo; Hengbo, Cui Cation Dependence of Crystal Structure and Band Parameters in a Series of Molecular Conductors, beta'-(Cation)[Pd(dmit)2]2 (dmit = 1,3-dithiole-2-thione-4,5-dithiolate) Crystals, 2012, 2, 861-874 |
1508467 | CIF | C17 H14 As Pd2 S20 | C 1 2/c 1 | 14.448; 6.3715; 37.282 90; 96.973; 90 | 3406.6 | Kato, Reizo; Hengbo, Cui Cation Dependence of Crystal Structure and Band Parameters in a Series of Molecular Conductors, beta'-(Cation)[Pd(dmit)2]2 (dmit = 1,3-dithiole-2-thione-4,5-dithiolate) Crystals, 2012, 2, 861-874 |
1508468 | CIF | C18 H16 Pd2 S20 Sb | C 1 2/c 1 | 14.628; 6.4235; 37.577 90; 97.577; 90 | 3500 | Kato, Reizo; Hengbo, Cui Cation Dependence of Crystal Structure and Band Parameters in a Series of Molecular Conductors, beta'-(Cation)[Pd(dmit)2]2 (dmit = 1,3-dithiole-2-thione-4,5-dithiolate) Crystals, 2012, 2, 861-874 |
1508469 | CIF | C18 H16 P Pd2 S20 | C 1 2/c 1 | 14.473; 6.3918; 37.859 90; 96.009; 90 | 3483 | Kato, Reizo; Hengbo, Cui Cation Dependence of Crystal Structure and Band Parameters in a Series of Molecular Conductors, beta'-(Cation)[Pd(dmit)2]2 (dmit = 1,3-dithiole-2-thione-4,5-dithiolate) Crystals, 2012, 2, 861-874 |
1508470 | CIF | C18 H16 As Pd2 S20 | C 1 2/c 1 | 14.495; 6.4; 37.816 90; 96.388; 90 | 3486.3 | Kato, Reizo; Hengbo, Cui Cation Dependence of Crystal Structure and Band Parameters in a Series of Molecular Conductors, beta'-(Cation)[Pd(dmit)2]2 (dmit = 1,3-dithiole-2-thione-4,5-dithiolate) Crystals, 2012, 2, 861-874 |
1508485 | CIF | C16 H13 F2 N3 O | C 1 2/c 1 | 17.6219; 10.8735; 15.3216 90; 102.864; 90 | 2862.11 | Jasinski, Jerry P.; Golen, James A.; Samshuddin, Seranthimata; Narayana, Badiadka; Yathirajan, Hemmige S. Synthesis, Characterization and Crystal Structures of 3,5-Bis(4-fluorophenyl)-4,5-dihydro-1H-pyrazole-1-carboxamide and 3,5-Bis(4-fluorophenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide Crystals, 2012, 2, 1108-1115 |
1513837 | CIF | C14 H22 N8 O25 W6 | C 1 2/c 1 | 16.81; 13.0514; 15.675 90; 109.73; 90 | 3237.1 | Kulikov, Vladislav; Meyer, Gerd Polyoxotungstates in Molecular Boxes of Purine Bases Crystals, 2014, 4, 64 |
1529351 | CIF | C4 H48 K0.28 N16 Ni2 O4 Rb7.72 Si18 | C 1 2/c 1 | 30.669; 9.919; 19.894 90; 110.18; 90 | 5680 | Gärtner, Stefanie; Hamberger, Markus; Korber, Nikolaus The First Chelate-Free Crystal Structure of a Silicide Transition Metal Complex [K0.28Rb7.72Si9Ni(CO)2]2·16NH3 Crystals, 2015, 5, 275 |
1549470 | CIF | H3 Na O8 Se2 V | C 1 2/c 1 | 18.5779; 7.5662; 12.5844 90; 111.612; 90 | 1644.6 | Stefano Canossa; Giovanni Predieri; Claudia Graiff Mild Synthesis and Structural Characterization of a Novel Vanadyl Selenite-Hydrogen Selenite Phase, Na[VO(SeO3)(HSeO3)].1,5H2O Crystals, 2018, 8, 215 |
1558499 | CIF | Ca7.97 Fe0.56 Mg9.47 O48 P12 | C 1 2/c 1 | 22.7973; 9.9833; 17.0522 90; 99.954; 90 | 3822.53 | Britvin, Sergey N.; Krzhizhanovskaya, Maria G.; Bocharov, Vladimir N.; Obolonskaya, Edita V. Crystal Chemistry of Stanfieldite, Ca7M2Mg9(PO4)12 (M = Ca, Mg, Fe2+), a Structural Base of Ca3Mg3(PO4)4 Phosphors Crystals, 2020, 10, 464 |
1560703 | CIF | C38 H32 Cl2 Ir N8 Pt | C 1 2/c 1 | 13.0437; 24.3865; 28.8657 90; 101.971; 90 | 8982.2 | Wu, Si-Hai; Ma, Dian-Xue; Gong, Zhong-Liang; Ma, Junjie; Shao, Jiang-Yang; Yang, Rong; Zhong, Yu-Wu Synthesis, Photophysical, and Computational Studies of a Bridged Ir^III^-Pt^II^ Heterodimetallic Complex Crystals, 2021, 11, 236 |
1567437 | CIF | C22 H18 N2 S2 Si | C 1 2/c 1 | 10.9877; 19.5766; 9.7361 90; 97.501; 90 | 2076.33 | Seidel, Anne; Weigel, Mareike; Ehrlich, Lisa; Gericke, Robert; Brendler, Erica; Wagler, Jörg Molecular Structures of the Silicon Pyridine-2-(thi)olates Me3Si(pyX), Me2Si(pyX)2 and Ph2Si(pyX)2 (py = 2-Pyridyl, X = O, S), and Their Intra- and Intermolecular Ligand Exchange in Solution Crystals, 2022, 12, 1054 |
1567589 | CIF | C33 H24 N4 | C 1 2/c 1 | 34.855; 8.6116; 30.178 90; 146.585; 90 | 4988.3 | Rocco, Dalila; Nikoletić, Anamarija; Prescimone, Alessandro; Constable, Edwin C.; Housecroft, Catherine E. To Be or Not to Be a (4,4) Net: Reactions of 4′-{4-(N,N-Diethylaminophenyl)}- and 4′-{4-(N,N-Diphenylaminophenyl)}-3,2′:6′,3″- and 4,2′:6′,4″-Terpyridines with Cobalt(II) Thiocyanate Crystals, 2022, 12, 1136 |
1567906 | CIF | C8 H26 F13 Fe3 N4 O | C 1 2/c 1 | 20.5365; 13.5405; 13.5727 90; 92.588; 90 | 3770.4 | Li, Teng; Lightfoot, Philip Layered Hybrid iron Fluorides Crystals, 2022, 12, 1443 |
1568592 | CIF | C6 H5 N O2 | C 1 2/c 1 | 21.211; 3.7625; 13.9555 90; 107.653; 90 | 1061.29 | Baptista, Diogo S.; Piedade, M. Fátima M.; Esteves, Catarina V. Solubility and Crystallization Studies of Picolinic Acid Crystals, 2023, 13, 392 |
1569036 | CIF | C12 H12 Br4 Co N4 O8 | C 1 2/c 1 | 18.3716; 11.4111; 13.2287 90; 132.282; 90 | 2051.8 | Sakhapov, Ilyas F.; Zagidullin, Almaz A.; Dobrynin, Alexey B.; Litvinov, Igor A.; Yakhvarov, Dmitry G.; Bondarenko, Mikhail A.; Novikov, Alexander S.; Fedin, Vladimir P.; Adonin, Sergey A. Crystal Structures of 3,3′,5,5′-Tetrabromo-4,4′-bipyridine and Co(II) Coordination Polymer Based Thereon Crystals, 2023, 13, 704 |
1569804 | CIF | C74 H46 N2 O12 Zn3 | C 1 2/c 1 | 11.4402; 30.8405; 27.0931 90; 96.884; 90 | 9490.1 | Lee, Dong Hee; Park, In-Hyeok Zn(II) Metal–Organic Frameworks with a Long Spacer Ligand and a Tricarboxylate Coligand Crystals, 2023, 13, 1266 |
1572513 | CIF | C14 H17 N16 O5.5 | C 1 2/c 1 | 25.774; 6.56343; 26.4567 90; 116.307; 90 | 4012.05 | Bojarska, Joanna; Łyczko, Krzysztof; Breza, Martin; Mieczkowski, Adam Recurrent Supramolecular Patterns in a Series of Salts of Heterocyclic Polyamines and Heterocyclic Dicarboxylic Acids: Synthesis, Single-Crystal X-ray Structure, Hirshfeld Surface Analysis, Energy Framework, and Quantum Chemical Calculations Crystals, 2024, 14, 733 |
1572517 | CIF | C25 H21 Co1.5 N6 O4 | C 1 2/c 1 | 23.741; 12.626; 19.3 90; 108.642; 90 | 5482 | Xiao, Caihong; Du, Shaowu First Examples of Metal-Organic Frameworks with Pore-Encapsulated [Co(CO)4]− Anions: Facile Synthesis, Crystal Structures and Stability Studies Crystals, 2024, 14, 731 |
1508407 | CIF | C10 H18 Ba N2 O18 | C 1 2/m 1 | 12.7393; 13.0111; 5.605 90; 104.208; 90 | 900.62 | Iveson, Samuel J.; Johnston, Chloe B.; Harrison, William T.A. Barium Oxalates Combined with Oxo-Anions and Organic Cations: Syntheses and Structures of Ba2(C2O4)(H2PO3)2 and C2H10N2 Ba(H2O)2(HC2O4)4 Crystals, 2012, 1, 59-68 |
1508421 | CIF | Ba5 Cd2 O2 Sb4 | C 1 2/m 1 | 17.247; 4.9279; 12.24 90; 132.558; 90 | 766.3 | Darone, Gregory M.; Bobev, Svilen Ba5Cd2Sb4O2, A New Antimonide Oxide with a Complex Structure Crystals, 2012, 1, 206-214 |
1570519 | CIF | C14 H16 Fe N8 Ni | C 1 2/m 1 | 16.452; 7.273; 7.423 90; 102.055; 90 | 868.6 | Kosuge, Ryota; Kawasaki, Takeshi; Kitase, Kosuke; Kosone, Takashi The Synthesis and Crystal Structures of New One- and Two-Dimensional Fe(II) Coordination Polymers Using Imidazole Derivatives Crystals, 2023, 13, 1658 |
1571109 | CIF | Al F5 Fe H14 O7 | C 1 2/m 1 | 10.918; 13.802; 6.521 90; 100.154; 90 | 967.26 | Seo, Jun Min; Jo, Hongil; Choi, Myung Ho; Ok, Kang Min; Chang, Hong Young; Kim, Sun Woo Polymorphisms in M2+AlF5(H2O)7 (M2+ = Fe2+, Co2+, or Ni2+): Syntheses, Crystal Structures, and Characterization of New Mixed Metal Fluoride Hydrates Crystals, 2024, 14, 197 |
1571110 | CIF | Al Co F5 H14 O7 | C 1 2/m 1 | 10.8749; 13.7822; 6.4894 90; 100.397; 90 | 956.7 | Seo, Jun Min; Jo, Hongil; Choi, Myung Ho; Ok, Kang Min; Chang, Hong Young; Kim, Sun Woo Polymorphisms in M2+AlF5(H2O)7 (M2+ = Fe2+, Co2+, or Ni2+): Syntheses, Crystal Structures, and Characterization of New Mixed Metal Fluoride Hydrates Crystals, 2024, 14, 197 |
1571111 | CIF | Al F5 H14 Ni O7 | C 1 2/m 1 | 10.788; 13.6952; 6.4554 90; 100.151; 90 | 938.82 | Seo, Jun Min; Jo, Hongil; Choi, Myung Ho; Ok, Kang Min; Chang, Hong Young; Kim, Sun Woo Polymorphisms in M2+AlF5(H2O)7 (M2+ = Fe2+, Co2+, or Ni2+): Syntheses, Crystal Structures, and Characterization of New Mixed Metal Fluoride Hydrates Crystals, 2024, 14, 197 |
1508500 | CIF | C3 H5 N3 O4 | C 1 c 1 | 3.6216; 17.385; 9.0259 90; 90.499; 90 | 568.26 | Laus, Gerhard; Kahlenberg, Volker Crystal Structures of 1-Hydroxyimidazole and Its Salts Crystals, 2012, 2, 1492-1501 |
1558501 | CIF | C18 H13.5 B Cu F4 N6 O0.75 | C 1 c 1 | 19.6546; 17.9133; 24.0581 90; 112.816; 90 | 7807.6 | Beveridge, Stuart; McAnally, Craig A.; Nichol, Gary S.; Kennedy, Alan R.; Cussen, Edmund J.; Fletcher, Ashleigh J. Unexpected Selective Gas Adsorption on a ‘Non-Porous’ Metal Organic Framework Crystals, 2020, 10, 548 |
1572516 | CIF | C10 H10 N4 O4 S2 | C 1 c 1 | 4.20086; 21.3241; 13.9944 90; 91.394; 90 | 1253.24 | Bojarska, Joanna; Łyczko, Krzysztof; Breza, Martin; Mieczkowski, Adam Recurrent Supramolecular Patterns in a Series of Salts of Heterocyclic Polyamines and Heterocyclic Dicarboxylic Acids: Synthesis, Single-Crystal X-ray Structure, Hirshfeld Surface Analysis, Energy Framework, and Quantum Chemical Calculations Crystals, 2024, 14, 733 |
1540502 | CIF | Al As3 Ba3 | C m c e | 19.854; 6.8636; 13.2849 90; 90; 90 | 1810.3 | Stoyko, Stanislav; Voss, Leonard; He, Hua; Bobev, Svilen Synthesis, Crystal and Electronic Structures of the Pnictides AE3TrPn3 (AE = Sr, Ba; Tr = Al, Ga; Pn = P, As) Crystals, 2015, 5, 433 |
1540504 | CIF | Al Ba3 P3 | C m c e | 19.3572; 6.7433; 12.9707 90; 90; 90 | 1693.1 | Stoyko, Stanislav; Voss, Leonard; He, Hua; Bobev, Svilen Synthesis, Crystal and Electronic Structures of the Pnictides AE3TrPn3 (AE = Sr, Ba; Tr = Al, Ga; Pn = P, As) Crystals, 2015, 5, 433 |
1540505 | CIF | Ga P3 Sr3 | C m c e | 18.787; 6.3867; 12.403 90; 90; 90 | 1488.2 | Stoyko, Stanislav; Voss, Leonard; He, Hua; Bobev, Svilen Synthesis, Crystal and Electronic Structures of the Pnictides AE3TrPn3 (AE = Sr, Ba; Tr = Al, Ga; Pn = P, As) Crystals, 2015, 5, 433 |
1540506 | CIF | Al As3 Sr3 | C m c e | 19.149; 6.5652; 12.6871 90; 90; 90 | 1595 | Stoyko, Stanislav; Voss, Leonard; He, Hua; Bobev, Svilen Synthesis, Crystal and Electronic Structures of the Pnictides AE3TrPn3 (AE = Sr, Ba; Tr = Al, Ga; Pn = P, As) Crystals, 2015, 5, 433 |
1508417 | CIF | Ba Ga1.79 Sn4.21 | C m c m | 4.5383; 12.2486; 14.3747 90; 90; 90 | 799.06 | Schαfer, Marion C.; Yamasaki, Yuki; Fritsch, Veronika; Bobev, Svilen Ternary Compounds in the Sn-Rich Section of the Ba-Ga-Sn System: Ba8Ga16-xSn30+x (1.1 <= x <= 2.8) Clathrates of Type-I and Type-VIII, and BaGa2-xSn4+x (x ? 0.2) with a Clathrate-like Structure Crystals, 2012, 1, 145-162 |
1572812 | CIF | Ag0.61 Pb1.79 Sb2.61 Se6 | C m c m | 4.2118; 13.859; 20.862 90; 90; 90 | 1217.74 | Grauer, Maxim; Benndorf, Christopher; Rohr, Valentin; Paulmann, Carsten; Oeckler, Oliver Investigations of Some Disordered Quaternary Compounds in the Systems Ag/Pb/Sb/Se and Ag/Pb/Sb/Te Crystals, 2024, 14, 789 |
1508377 | CIF | C6 H10 B F4 N5 O2 S | F d d 2 | 24.375; 30.163; 13.653 90; 90; 90 | 10038 | Laus, Gerhard; Adamer, Verena; Hummel, Michael; Kahlenberg, Volker; Wurst, Klaus; Nerdinger, Sven; Schottenberger, Herwig Crystal Structure of 2-Ethylimidazole-1-sulfonyl Azide: A New Azidation Reagent Crystals, 2012, 2, 118-126 |
1569803 | CIF | C47 H31 N2 O7 Zn2 | F d d 2 | 60.5386; 62.2276; 5.9086 90; 90; 90 | 22258.7 | Lee, Dong Hee; Park, In-Hyeok Zn(II) Metal–Organic Frameworks with a Long Spacer Ligand and a Tricarboxylate Coligand Crystals, 2023, 13, 1266 |
1572810 | CIF | Ag0.33 Pb0.33 Sb0.33 Se | F m -3 m | 5.9268; 5.9268; 5.9268 90; 90; 90 | 208.19 | Grauer, Maxim; Benndorf, Christopher; Rohr, Valentin; Paulmann, Carsten; Oeckler, Oliver Investigations of Some Disordered Quaternary Compounds in the Systems Ag/Pb/Sb/Se and Ag/Pb/Sb/Te Crystals, 2024, 14, 789 |
1508491 | CIF | C12 H10 Au0.94 Cl1.88 N2 S6 | I -4 2 d | 7.3259; 7.3259; 67.5487 90; 90; 90 | 3625.26 | Psycharis, Vassilis; Mousdis, George A.; Murata, Keizo; Papavassiliou, George C. Structural and Electrical Properties of the tau-(P-S,S-DMEDT-TTF)2 (AuCl2) (AuCl2)y Compound with (y <> 0.9) Crystals, 2012, 2, 1283-1290 |
1508492 | CIF | C12 H10 Au0.94 Cl1.88 N2 S6 | I -4 2 d | 7.3066; 7.3066; 67.3719 90; 90; 90 | 3596.74 | Psycharis, Vassilis; Mousdis, George A.; Murata, Keizo; Papavassiliou, George C. Structural and Electrical Properties of the tau-(P-S,S-DMEDT-TTF)2 (AuCl2) (AuCl2)y Compound with (y <> 0.9) Crystals, 2012, 2, 1283-1290 |
1508419 | CIF | Ba8 Ga13.2 Sn32.8 | I -4 3 m | 11.5843; 11.5843; 11.5843 90; 90; 90 | 1554.57 | Schαfer, Marion C.; Yamasaki, Yuki; Fritsch, Veronika; Bobev, Svilen Ternary Compounds in the Sn-Rich Section of the Ba-Ga-Sn System: Ba8Ga16-xSn30+x (1.1 <= x <= 2.8) Clathrates of Type-I and Type-VIII, and BaGa2-xSn4+x (x ? 0.2) with a Clathrate-like Structure Crystals, 2012, 1, 145-162 |
1564146 | CIF | C49.8 H81.1 O15.75 | I 1 2 1 | 14.8197; 9.1753; 39.094 90; 94.49; 90 | 5299.5 | Shubin, Kirill; Bērziņš, Agris; Belyakov, Sergey Crystal Structures of New Ivermectin Pseudopolymorphs Crystals, 2021, 11, 172 |
1570568 | CIF | Dy2 O5 Si | I 1 2/a 1 | 10.4642; 6.74981; 12.5396 90; 102.739; 90 | 863.89 | Ciomaga Hatnean, Vasile Cristian; Pui, Aurel; Simonov, Arkadiy; Ciomaga Hatnean, Monica Crystal Growth of the R2SiO5 Compounds (R = Dy, Ho, and Er) by the Floating Zone Method Using a Laser-Diode-Heated Furnace Crystals, 2023, 13, 1687 |
1570569 | CIF | Dy2 O5 Si | I 1 2/a 1 | 10.4617; 6.74837; 12.5382 90; 102.748; 90 | 863.37 | Ciomaga Hatnean, Vasile Cristian; Pui, Aurel; Simonov, Arkadiy; Ciomaga Hatnean, Monica Crystal Growth of the R2SiO5 Compounds (R = Dy, Ho, and Er) by the Floating Zone Method Using a Laser-Diode-Heated Furnace Crystals, 2023, 13, 1687 |
1570570 | CIF | Er2 O5 Si | I 1 2/a 1 | 10.369; 6.7028; 12.464 90; 102.533; 90 | 845.62 | Ciomaga Hatnean, Vasile Cristian; Pui, Aurel; Simonov, Arkadiy; Ciomaga Hatnean, Monica Crystal Growth of the R2SiO5 Compounds (R = Dy, Ho, and Er) by the Floating Zone Method Using a Laser-Diode-Heated Furnace Crystals, 2023, 13, 1687 |
1570571 | CIF | Ho2 O5 Si | I 1 2/a 1 | 10.4156; 6.7273; 12.5019 90; 102.63; 90 | 854.8 | Ciomaga Hatnean, Vasile Cristian; Pui, Aurel; Simonov, Arkadiy; Ciomaga Hatnean, Monica Crystal Growth of the R2SiO5 Compounds (R = Dy, Ho, and Er) by the Floating Zone Method Using a Laser-Diode-Heated Furnace Crystals, 2023, 13, 1687 |
1568589 | CIF | Cl2 H12 Ni O6 | I 1 2/m 1 | 6.5628; 7.033; 8.7326 90; 96.723; 90 | 400.29 | Boeré, René T. Crystal Structures of CuCl2·2H2O (Eriochalcite) and NiCl2∙6H2O (Nickelbischofite) at Low Temperature: Full Refinement of Hydrogen Atoms Using Non-Spherical Atomic Scattering Factors Crystals, 2023, 13, 293 |
1568590 | CIF | Cl2 H12 Ni O6 | I 1 2/m 1 | 6.5579; 7.0244; 8.7291 90; 96.702; 90 | 399.36 | Boeré, René T. Crystal Structures of CuCl2·2H2O (Eriochalcite) and NiCl2∙6H2O (Nickelbischofite) at Low Temperature: Full Refinement of Hydrogen Atoms Using Non-Spherical Atomic Scattering Factors Crystals, 2023, 13, 293 |
1508472 | CIF | C7 H8 B Br3 F4 N2 | I 41/a :2 | 23.6138; 23.6138; 18.8371 90; 90; 90 | 10503.8 | Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig Halogen Interactions in 2,4,5-Tribromoimidazolium Salts Crystals, 2012, 2, 1017-1033 |
1508475 | CIF | C7 H6 B Br3 F4 N2 | I 41/a :2 | 23.4674; 23.4674; 18.6531 90; 90; 90 | 10272.6 | Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig Halogen Interactions in 2,4,5-Tribromoimidazolium Salts Crystals, 2012, 2, 1017-1033 |
1508487 | CIF | Ce10 O Se14 | I 41/a c d :2 | 15.7896; 15.7896; 20.8659 90; 90; 90 | 5202.1 | Weber, Frank A.; Schurz, Christian M.; Frunder, Susanne; Kuhn, Charlotte F.; Schleid, Thomas The Short Series of the Oxygen-Poor Lanthanide Oxide Selenides M10OSe14 with M = La-Nd Crystals, 2012, 2, 1136-1145 |
1508488 | CIF | La10 O Se14 | I 41/a c d :2 | 15.9204; 15.9204; 21.0648 90; 90; 90 | 5339.1 | Weber, Frank A.; Schurz, Christian M.; Frunder, Susanne; Kuhn, Charlotte F.; Schleid, Thomas The Short Series of the Oxygen-Poor Lanthanide Oxide Selenides M10OSe14 with M = La-Nd Crystals, 2012, 2, 1136-1145 |
1508489 | CIF | Nd10 O Se14 | I 41/a c d :2 | 15.5983; 15.5983; 20.6291 90; 90; 90 | 5019.2 | Weber, Frank A.; Schurz, Christian M.; Frunder, Susanne; Kuhn, Charlotte F.; Schleid, Thomas The Short Series of the Oxygen-Poor Lanthanide Oxide Selenides M10OSe14 with M = La-Nd Crystals, 2012, 2, 1136-1145 |
1508490 | CIF | O Pr10 Se14 | I 41/a c d :2 | 15.6874; 15.6874; 20.7342 90; 90; 90 | 5102.6 | Weber, Frank A.; Schurz, Christian M.; Frunder, Susanne; Kuhn, Charlotte F.; Schleid, Thomas The Short Series of the Oxygen-Poor Lanthanide Oxide Selenides M10OSe14 with M = La-Nd Crystals, 2012, 2, 1136-1145 |
1508367 | CIF | C24 H32 I2 O8 | P -1 | 4.8499; 12.037; 12.804 64.561; 86.815; 83.893 | 671.1 | Walbaum, Christine; Pantenburg, Ingo; Meyer, Gerd Iodine Molecules Included in the Structure of Dibenzo-24-Crown-8, (I2)@(db24c8) Crystals, 2011, 1, 215-219 |
1508373 | CIF | C8 H15 N11 O8 | P -1 | 6.7224; 10.7473; 11.9604 113.212; 90.579; 99.815 | 779.68 | Deblitz, Raik; Hrib, Cristian G.; Plenikowski, Georg; Edelmann, Frank T. Molecular and Crystal Structure of a New High Energy Density Material: Aminoguanidinium-styphnate, [H2NNHC(NH2)2]2[C6HO2(NO2)3] Crystals, 2012, 2, 34-42 |
1508379 | CIF | C15 H13 N3 O3 | P -1 | 6.8994; 9.8052; 11.1525 71.729; 79.436; 74.349 | 685.83 | Mamat, Constantin; Köckerling, Martin The Synthesis and Molecular Structure of 2-(4-Methoxybenzyl)-4-nitro-2H-indazole Crystals, 2012, 2, 176-181 |
1508380 | CIF | C54 H44 N2 O6 P2 S2 | P -1 | 9.859; 13.683; 9.664 105.04; 93.651; 110.735 | 1159.9 | Akutsu, Hiroki; Yamada, Jun-ichi; Nakatsuji, Shin-ichi; Turner, Scott S. A New BEDT-TTF-Based Organic Charge Transfer Salt with a New Anionic Strong Acceptor, N,N'-Disulfo-1,4-benzoquinonediimine Crystals, 2012, 2, 182-192 |
1508381 | CIF | C46 H42 N2 O9 S34 | P -1 | 6.742; 15.518; 18.034 74.29; 82.16; 80.36 | 1782.4 | Akutsu, Hiroki; Yamada, Jun-ichi; Nakatsuji, Shin-ichi; Turner, Scott S. A New BEDT-TTF-Based Organic Charge Transfer Salt with a New Anionic Strong Acceptor, N,N'-Disulfo-1,4-benzoquinonediimine Crystals, 2012, 2, 182-192 |
1508385 | CIF | C11 H14 O4 | P -1 | 8.5518; 10.8826; 11.9939 101.273; 98.287; 94.092 | 1077.54 | Khan, Imtiaz; Ibrar, Aliya; White, Jonathan M. Ethyl 2,6-Dimethoxybenzoate: Synthesis, Spectroscopic and X-ray Crystallographic Analysis Crystals, 2012, 2, 521-527 |
1508390 | CIF | C2 H4 Cu N8 O2 | P -1 | 7.4137; 7.489; 7.5391 118.928; 109.295; 92.47 | 335.18 | Joas, Manuel; Klapοtke, Thomas M.; Stierstorfer, Jοrg Preparation and Crystal Structure of Diaqua(?-5,5'-bistetrazolato-?4N1,N2,N5,N6)copper(II) Crystals, 2012, 2, 958-966 |
1508396 | CIF | C20 H44 B4 Cu2 F16 N8 O4 | P -1 | 9.455; 12.0445; 16.493 87.469; 83.061; 75.465 | 1804.6 | Olguin, Juan; Bernes, Sylvain; Gasque, Laura Fluoride Ion as Ligand and Hydrogen Bond Acceptor: Crystal Structures of Two Dinuclear CuII Complexes Built on a Diazecine Template Crystals, 2012, 2, 1357-1365 |
1508398 | CIF | C5 H12 Br3 Cu2 N | P -1 | 6.2948; 8.2624; 10.7612 75.964; 89.232; 84.072 | 540.04 | Komm, Theresa; Biner, Daniel; Neels, Antonia; Kramer, Karl W. (C5H12N)Cu2Br3: A Piperidinium Copper(I) Bromide with [Cu2Br3]? Ladders Crystals, 2012, 2, 1434-1440 |
1508423 | CIF | C14 H27.91 B18 Cl2.09 Co S8 | P -1 | 8.8565; 13.349; 14.654 106.617; 102.684; 98.963 | 1574.7 | Kazheva, Olga N.; Aleksandrov, Grigory G.; Kravchenko, Andrey V.; Starodub, Vladimir A.; Lobanova, Irina A.; Kosenko, Irina D.; Sivaev, Igor B.; Bregadze, Vladimir I.; Buravov, Lev I.; Dyachenko, Oleg A. New Fulvalenium Salts of Cobalt Bis(dicarbollide): Crystal Structures and Electrical Conductivities Crystals, 2012, 2, 43-55 |
1508424 | CIF | C14 H27.75 B18 Br0.75 Cl1.25 Co S8 | P -1 | 8.7106; 13.441; 14.742 106.991; 101.784; 99.504 | 1568.6 | Kazheva, Olga N.; Aleksandrov, Grigory G.; Kravchenko, Andrey V.; Starodub, Vladimir A.; Lobanova, Irina A.; Kosenko, Irina D.; Sivaev, Igor B.; Bregadze, Vladimir I.; Buravov, Lev I.; Dyachenko, Oleg A. New Fulvalenium Salts of Cobalt Bis(dicarbollide): Crystal Structures and Electrical Conductivities Crystals, 2012, 2, 43-55 |
1508425 | CIF | C36 H36.84 B18 Br1.16 Co O0.72 S32 | P -1 | 10.809; 16.187; 20.412 100.22; 100.43; 107.21 | 3252.1 | Kazheva, Olga N.; Aleksandrov, Grigory G.; Kravchenko, Andrey V.; Starodub, Vladimir A.; Lobanova, Irina A.; Kosenko, Irina D.; Sivaev, Igor B.; Bregadze, Vladimir I.; Buravov, Lev I.; Dyachenko, Oleg A. New Fulvalenium Salts of Cobalt Bis(dicarbollide): Crystal Structures and Electrical Conductivities Crystals, 2012, 2, 43-55 |
1508426 | CIF | C8 H18 N12 | P -1 | 8.7982; 8.8927; 9.7756 67.827; 86.181; 71.794 | 671.68 | Laus, Gerhard; Kahlenberg, Volker; Wurst, Klaus; Hummel, Michael; Schottenberger, Herwig 1,4-Diazabicyclo[2.2.2]octane (DABCO) 5-aminotetrazolates Crystals, 2012, 2, 96-104 |
1508431 | CIF | C4 H9 N5 S | P -1 | 5.9032; 7.4591; 9.2538 113.598; 98.37; 99.017 | 358.88 | Laus, Gerhard; Kahlenberg, Volker; Wurst, Klaus; Schottenberger, Herwig; Fischer, Niko; Stierstorfer, Jοrg; Klapοtke, Thomas M. Synthesis and Crystal Structures of New 5,5'-Azotetrazolates Crystals, 2012, 2, 127-136 |
1508434 | CIF | C6 H14 N6 O | P -1 | 5.49; 8.4206; 10.3003 78.564; 85.796; 81.876 | 461.53 | Laus, Gerhard; Kahlenberg, Volker; Wurst, Klaus; Schottenberger, Herwig; Fischer, Niko; Stierstorfer, Jοrg; Klapοtke, Thomas M. Synthesis and Crystal Structures of New 5,5'-Azotetrazolates Crystals, 2012, 2, 127-136 |
1508447 | CIF | C29 H21 N4 O2 S16 | P -1 | 17.3403; 20.1481; 23.9412 84.225; 69.596; 76.254 | 7613.6 | Benmansour, Samia; Marchivie, Mathieu; Triki, Smail; Gomez-Garcia, Carlos J. Polymorphism and Metallic Behavior in BEDT-TTF Radical Salts with Polycyano Anions Crystals, 2012, 2, 306-326 |
1508448 | CIF | C29 H21 N4 O2 S16 | P -1 | 10.2496; 11.2314; 18.0649 96.525; 90.593; 115.397 | 1862.4 | Benmansour, Samia; Marchivie, Mathieu; Triki, Smail; Gomez-Garcia, Carlos J. Polymorphism and Metallic Behavior in BEDT-TTF Radical Salts with Polycyano Anions Crystals, 2012, 2, 306-326 |
1508449 | CIF | C31 H24.5 Cl1.5 N4 O2 S16 | P -1 | 7.6688; 12.6432; 22.6204 98.43; 98.463; 106.246 | 2041.6 | Benmansour, Samia; Marchivie, Mathieu; Triki, Smail; Gomez-Garcia, Carlos J. Polymorphism and Metallic Behavior in BEDT-TTF Radical Salts with Polycyano Anions Crystals, 2012, 2, 306-326 |
1508450 | CIF | C16 H5 Cl2 I N2 O2 S6 | P -1 | 7.0227; 12.676; 13.1732 62.169; 76.282; 78.615 | 1002.31 | Lieffrig, Julien; Jeannin, Olivier; Shin, Kyoung-Soon; Auban-Senzier, Pascale; Fourmigue, Marc Halogen Bonding Interactions in DDQ Charge Transfer Salts with Iodinated TTFs Crystals, 2012, 2, 327-337 |
1508451 | CIF | C26 H11 Cl2 I4 N3 O2 S12 | P -1 | 7.4173; 12.9354; 21.258 79.6; 85.564; 75.854 | 1944.1 | Lieffrig, Julien; Jeannin, Olivier; Shin, Kyoung-Soon; Auban-Senzier, Pascale; Fourmigue, Marc Halogen Bonding Interactions in DDQ Charge Transfer Salts with Iodinated TTFs Crystals, 2012, 2, 327-337 |
1508452 | CIF | C84 H152 N4 O32 W10 | P -1 | 10.7727; 11.3734; 23.982 98.566; 95.298; 116.168 | 2566.1 | Ito, Takeru; Fujimoto, Nozomu; Uchida, Sayaka; Iijima, Jun; Naruke, Haruo; Mizuno, Noritaka Polyoxotungstate-Surfactant Layered Crystal toward Conductive Inorganic-Organic Hybrid Crystals, 2012, 2, 362-373 |
1508454 | CIF | C12 H11 O4.5 Re S6 Se2 | P -1 | 8.532; 9.75; 13.597 94.949; 94.723; 93.783 | 1120 | Furuta, Keisuke; Kohno, Shuhei; Shirahata, Takashi; Yamasaki, Koya; Hino, Shojun; Misaki, Yohji Synthesis and Properties of 2-Alkylidene-1,3-dithiolo[4,5-d]-4,5-ethylenediselenotetrathiafulvalene Derivatives and Crystal Structures of Their Cation Radical Salts Crystals, 2012, 2, 393-412 |
1508455 | CIF | C25 H22 Cl I6 S12 Se4 | P -1 | 7.893; 8.594; 34.646 89.481; 84.178; 77.788 | 2284.9 | Furuta, Keisuke; Kohno, Shuhei; Shirahata, Takashi; Yamasaki, Koya; Hino, Shojun; Misaki, Yohji Synthesis and Properties of 2-Alkylidene-1,3-dithiolo[4,5-d]-4,5-ethylenediselenotetrathiafulvalene Derivatives and Crystal Structures of Their Cation Radical Salts Crystals, 2012, 2, 393-412 |
1508456 | CIF | C14 H12 I3 S6 Se2 | P -1 | 8.443; 8.859; 16.686 84.118; 89.712; 68.365 | 1153.3 | Furuta, Keisuke; Kohno, Shuhei; Shirahata, Takashi; Yamasaki, Koya; Hino, Shojun; Misaki, Yohji Synthesis and Properties of 2-Alkylidene-1,3-dithiolo[4,5-d]-4,5-ethylenediselenotetrathiafulvalene Derivatives and Crystal Structures of Their Cation Radical Salts Crystals, 2012, 2, 393-412 |
1508457 | CIF | C30 H24 Cl5 N O Os S24 | P -1 | 7.6672; 9.8657; 17.9733 91.151; 93.636; 102.434 | 1324.2 | Zorina, Leokadiya; Simonov, Sergey; Canadell, Enric; Shibaeva, Rimma Single-Crystal-to-Single-Crystal Transformation from delta-(BEDT-TTF)4[OsNOCl5]1.33(C6H5NO2)0.67 to beta''"-(BEDT-TTF)3[OsNOCl5] Crystals, 2012, 2, 627-642 |
1508461 | CIF | C8 H7 N O5 | P -1 | 7.2831; 10.522; 11.41 83.38; 80.83; 82.02 | 851 | Fu, Xin-Ling; Li, Jiang-Sheng; Simpson, Jim Non-Covalent Interactions in the Crystal Structure of Methyl 4-Hydroxy-3-Nitrobenzoate Crystals, 2012, 2, 669-674 |
1508474 | CIF | C8 H8 Br3 F6 N2 P | P -1 | 8.2368; 13.4522; 13.6605 92.476; 100.965; 92.884 | 1481.96 | Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig Halogen Interactions in 2,4,5-Tribromoimidazolium Salts Crystals, 2012, 2, 1017-1033 |
1508476 | CIF | C9 H6 Br3 F6 N3 O4 S2 | P -1 | 7.5438; 8.6311; 15.9716 75.02; 87.083; 66.58 | 920.25 | Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig Halogen Interactions in 2,4,5-Tribromoimidazolium Salts Crystals, 2012, 2, 1017-1033 |
1508477 | CIF | C8 H8 Br5 F6 N2 P | P -1 | 7.6729; 7.8858; 15.8383 90.001; 88.104; 62.169 | 846.88 | Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig Halogen Interactions in 2,4,5-Tribromoimidazolium Salts Crystals, 2012, 2, 1017-1033 |
1508478 | CIF | C8 H8 Br6 N2 | P -1 | 7.32; 11.5867; 18.1972 87.611; 81.121; 86.375 | 1521 | Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig Halogen Interactions in 2,4,5-Tribromoimidazolium Salts Crystals, 2012, 2, 1017-1033 |
1508483 | CIF | C17 H12.5 Cl0.5 F6 O P S4 Se4 | P -1 | 7.917; 10.582; 15.979 76.666; 89.916; 89.124 | 1302.4 | Ishidzu, Ken-ichi; Ashizawa, Minoru; Watanabe, Masaki; Shirahata, Takashi; Misaki, Yohji Synthesis, Structures and Properties of Molecular Conductors Based on Bis-Fused Donors Composed of (Thio)Pyran-4-ylidene-1,3-dithiole and Tetraselenafulvalene Crystals, 2012, 2, 1092-1107 |
1508484 | CIF | C40 H30 Cl2 F12 P2 S10 Se8 | P -1 | 12.666; 14.299; 16.289 85.39; 88.219; 79.788 | 2893.6 | Ishidzu, Ken-ichi; Ashizawa, Minoru; Watanabe, Masaki; Shirahata, Takashi; Misaki, Yohji Synthesis, Structures and Properties of Molecular Conductors Based on Bis-Fused Donors Composed of (Thio)Pyran-4-ylidene-1,3-dithiole and Tetraselenafulvalene Crystals, 2012, 2, 1092-1107 |
1508499 | CIF | C6 H10 N4 O6 S | P -1 | 6.5611; 7.7322; 12.1134 97.82; 91.912; 113.295 | 556.62 | Laus, Gerhard; Kahlenberg, Volker Crystal Structures of 1-Hydroxyimidazole and Its Salts Crystals, 2012, 2, 1492-1501 |
1513838 | CIF | C21 H45 N12 O46.5 W10 | P -1 | 13.4905; 15.1707; 17.0692 79.594; 89.386; 70.001 | 3223.8 | Kulikov, Vladislav; Meyer, Gerd Polyoxotungstates in Molecular Boxes of Purine Bases Crystals, 2014, 4, 64 |
1540508 | CIF | C10 H18 O2 | P -1 | 4.1405; 15.2839; 17.7089 68.3291; 83.385; 85.0779 | 1033.39 | Sonneck, Marcel; Peppel, Tim; Spannenberg, Anke; Wohlrab, Sebastian Synthesis and Molecular Structures of (E)-non-2-enoic Acid and (E)-dec-2-enoic Acid Crystals, 2015, 5, 466 |
1540634 | CIF | C26 H29 Br N2 O7 S | P -1 | 8.3812; 13.0305; 13.2656 64.054; 83.078; 86.643 | 1293.2 | Mizoguchi, Kenji; Sakamoto, Hirokazu Role ofWater Molecules to the Electronic States of M-DNA Crystals, 2015, 5, 475 |
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