Crystallography Open Database

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1508383 CIFC35 H27 Cl2 N3 S12 ZnC 1 2/c 111.8152; 10.1; 35.579
90; 98.111; 90
4203.3Nita, Gabriela; Branzea, Diana; Pop, Flavia; El-Ghayoury, Abdelkrim; Avarvari, Narcis
Electroactive Bisiminopyridine Ligands: Synthesis and Complexation Studies
Crystals, 2012, 2, 338-348
1508384 CIFC20 H20 B0.5 N OC 1 2/c 121.4373; 6.1623; 23.2775
90; 97.597; 90
3048Bag, 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 CIFC26 H24 O5C 1 2/c 125.4114; 8.4744; 20.6921
90; 108.328; 90
4229.93Kaur, 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 CIFC H2 Ba O5 PC 1 2/c 112.3829; 7.9124; 11.0858
90; 114.788; 90
986.1Iveson, 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 CIFC H3 Ag N6C 1 2/c 118.0338; 3.601; 14.906
90; 91.94; 90
967.4Laus, 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 CIFC27 H20 N3 O0.5 S16C 1 2/c 115.7423; 13.2947; 33.81
90; 96.701; 90
7027.7Benmansour, 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 CIFC25 H18 N3 O S16C 1 2/c 115.5152; 13.2644; 33.673
90; 97.443; 90
6871.5Benmansour, 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 CIFC16 H12 Pd2 S20 SbC 1 2/c 114.325; 6.403; 36.893
90; 97.543; 90
3355Kato, 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 CIFC16 H12 P Pd2 S20C 1 2/c 114.379; 6.3539; 36.496
90; 98.07; 90
3301.4Kato, 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 CIFC16 H12 As Pd2 S20C 1 2/c 114.383; 6.3691; 36.672
90; 97.793; 90
3328.4Kato, 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 CIFC17 H14 Pd2 S20 SbC 1 2/c 114.503; 6.3989; 37.244
90; 97.352; 90
3427.9Kato, 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 CIFC17 H14 P Pd2 S20C 1 2/c 114.437; 6.3614; 37.243
90; 96.938; 90
3395.3Kato, 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 CIFC17 H14 As Pd2 S20C 1 2/c 114.448; 6.3715; 37.282
90; 96.973; 90
3406.6Kato, 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 CIFC18 H16 Pd2 S20 SbC 1 2/c 114.628; 6.4235; 37.577
90; 97.577; 90
3500Kato, 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 CIFC18 H16 P Pd2 S20C 1 2/c 114.473; 6.3918; 37.859
90; 96.009; 90
3483Kato, 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 CIFC18 H16 As Pd2 S20C 1 2/c 114.495; 6.4; 37.816
90; 96.388; 90
3486.3Kato, 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 CIFC16 H13 F2 N3 OC 1 2/c 117.6219; 10.8735; 15.3216
90; 102.864; 90
2862.11Jasinski, 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 CIFC14 H22 N8 O25 W6C 1 2/c 116.81; 13.0514; 15.675
90; 109.73; 90
3237.1Kulikov, Vladislav; Meyer, Gerd
Polyoxotungstates in Molecular Boxes of Purine Bases
Crystals, 2014, 4, 64
1529351 CIFC4 H48 K0.28 N16 Ni2 O4 Rb7.72 Si18C 1 2/c 130.669; 9.919; 19.894
90; 110.18; 90
5680Gärtner, 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 CIFH3 Na O8 Se2 VC 1 2/c 118.5779; 7.5662; 12.5844
90; 111.612; 90
1644.6Stefano 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 CIFCa7.97 Fe0.56 Mg9.47 O48 P12C 1 2/c 122.7973; 9.9833; 17.0522
90; 99.954; 90
3822.53Britvin, 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 CIFC38 H32 Cl2 Ir N8 PtC 1 2/c 113.0437; 24.3865; 28.8657
90; 101.971; 90
8982.2Wu, 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 CIFC22 H18 N2 S2 SiC 1 2/c 110.9877; 19.5766; 9.7361
90; 97.501; 90
2076.33Seidel, 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 CIFC33 H24 N4C 1 2/c 134.855; 8.6116; 30.178
90; 146.585; 90
4988.3Rocco, 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 CIFC8 H26 F13 Fe3 N4 OC 1 2/c 120.5365; 13.5405; 13.5727
90; 92.588; 90
3770.4Li, Teng; Lightfoot, Philip
Layered Hybrid iron Fluorides
Crystals, 2022, 12, 1443
1568592 CIFC6 H5 N O2C 1 2/c 121.211; 3.7625; 13.9555
90; 107.653; 90
1061.29Baptista, Diogo S.; Piedade, M. Fátima M.; Esteves, Catarina V.
Solubility and Crystallization Studies of Picolinic Acid
Crystals, 2023, 13, 392
1569036 CIFC12 H12 Br4 Co N4 O8C 1 2/c 118.3716; 11.4111; 13.2287
90; 132.282; 90
2051.8Sakhapov, 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 CIFC74 H46 N2 O12 Zn3C 1 2/c 111.4402; 30.8405; 27.0931
90; 96.884; 90
9490.1Lee, Dong Hee; Park, In-Hyeok
Zn(II) Metal–Organic Frameworks with a Long Spacer Ligand and a Tricarboxylate Coligand
Crystals, 2023, 13, 1266
1572513 CIFC14 H17 N16 O5.5C 1 2/c 125.774; 6.56343; 26.4567
90; 116.307; 90
4012.05Bojarska, 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 CIFC25 H21 Co1.5 N6 O4C 1 2/c 123.741; 12.626; 19.3
90; 108.642; 90
5482Xiao, 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 CIFC10 H18 Ba N2 O18C 1 2/m 112.7393; 13.0111; 5.605
90; 104.208; 90
900.62Iveson, 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 CIFBa5 Cd2 O2 Sb4C 1 2/m 117.247; 4.9279; 12.24
90; 132.558; 90
766.3Darone, Gregory M.; Bobev, Svilen
Ba5Cd2Sb4O2, A New Antimonide Oxide with a Complex Structure
Crystals, 2012, 1, 206-214
1570519 CIFC14 H16 Fe N8 NiC 1 2/m 116.452; 7.273; 7.423
90; 102.055; 90
868.6Kosuge, 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 CIFAl F5 Fe H14 O7C 1 2/m 110.918; 13.802; 6.521
90; 100.154; 90
967.26Seo, 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 CIFAl Co F5 H14 O7C 1 2/m 110.8749; 13.7822; 6.4894
90; 100.397; 90
956.7Seo, 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 CIFAl F5 H14 Ni O7C 1 2/m 110.788; 13.6952; 6.4554
90; 100.151; 90
938.82Seo, 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 CIFC3 H5 N3 O4C 1 c 13.6216; 17.385; 9.0259
90; 90.499; 90
568.26Laus, Gerhard; Kahlenberg, Volker
Crystal Structures of 1-Hydroxyimidazole and Its Salts
Crystals, 2012, 2, 1492-1501
1558501 CIFC18 H13.5 B Cu F4 N6 O0.75C 1 c 119.6546; 17.9133; 24.0581
90; 112.816; 90
7807.6Beveridge, 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 CIFC10 H10 N4 O4 S2C 1 c 14.20086; 21.3241; 13.9944
90; 91.394; 90
1253.24Bojarska, 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 CIFAl As3 Ba3C m c e19.854; 6.8636; 13.2849
90; 90; 90
1810.3Stoyko, 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 CIFAl Ba3 P3C m c e19.3572; 6.7433; 12.9707
90; 90; 90
1693.1Stoyko, 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 CIFGa P3 Sr3C m c e18.787; 6.3867; 12.403
90; 90; 90
1488.2Stoyko, 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 CIFAl As3 Sr3C m c e19.149; 6.5652; 12.6871
90; 90; 90
1595Stoyko, 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 CIFBa Ga1.79 Sn4.21C m c m4.5383; 12.2486; 14.3747
90; 90; 90
799.06Schαfer, 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 CIFAg0.61 Pb1.79 Sb2.61 Se6C m c m4.2118; 13.859; 20.862
90; 90; 90
1217.74Grauer, 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 CIFC6 H10 B F4 N5 O2 SF d d 224.375; 30.163; 13.653
90; 90; 90
10038Laus, 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 CIFC47 H31 N2 O7 Zn2F d d 260.5386; 62.2276; 5.9086
90; 90; 90
22258.7Lee, Dong Hee; Park, In-Hyeok
Zn(II) Metal–Organic Frameworks with a Long Spacer Ligand and a Tricarboxylate Coligand
Crystals, 2023, 13, 1266
1572810 CIFAg0.33 Pb0.33 Sb0.33 SeF m -3 m5.9268; 5.9268; 5.9268
90; 90; 90
208.19Grauer, 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 CIFC12 H10 Au0.94 Cl1.88 N2 S6I -4 2 d7.3259; 7.3259; 67.5487
90; 90; 90
3625.26Psycharis, 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 CIFC12 H10 Au0.94 Cl1.88 N2 S6I -4 2 d7.3066; 7.3066; 67.3719
90; 90; 90
3596.74Psycharis, 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 CIFBa8 Ga13.2 Sn32.8I -4 3 m11.5843; 11.5843; 11.5843
90; 90; 90
1554.57Schαfer, 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 CIFC49.8 H81.1 O15.75I 1 2 114.8197; 9.1753; 39.094
90; 94.49; 90
5299.5Shubin, Kirill; Bērziņš, Agris; Belyakov, Sergey
Crystal Structures of New Ivermectin Pseudopolymorphs
Crystals, 2021, 11, 172
1570568 CIFDy2 O5 SiI 1 2/a 110.4642; 6.74981; 12.5396
90; 102.739; 90
863.89Ciomaga 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 CIFDy2 O5 SiI 1 2/a 110.4617; 6.74837; 12.5382
90; 102.748; 90
863.37Ciomaga 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 CIFEr2 O5 SiI 1 2/a 110.369; 6.7028; 12.464
90; 102.533; 90
845.62Ciomaga 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 CIFHo2 O5 SiI 1 2/a 110.4156; 6.7273; 12.5019
90; 102.63; 90
854.8Ciomaga 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 CIFCl2 H12 Ni O6I 1 2/m 16.5628; 7.033; 8.7326
90; 96.723; 90
400.29Boeré, 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 CIFCl2 H12 Ni O6I 1 2/m 16.5579; 7.0244; 8.7291
90; 96.702; 90
399.36Boeré, 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 CIFC7 H8 B Br3 F4 N2I 41/a :223.6138; 23.6138; 18.8371
90; 90; 90
10503.8Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig
Halogen Interactions in 2,4,5-Tribromoimidazolium Salts
Crystals, 2012, 2, 1017-1033
1508475 CIFC7 H6 B Br3 F4 N2I 41/a :223.4674; 23.4674; 18.6531
90; 90; 90
10272.6Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig
Halogen Interactions in 2,4,5-Tribromoimidazolium Salts
Crystals, 2012, 2, 1017-1033
1508487 CIFCe10 O Se14I 41/a c d :215.7896; 15.7896; 20.8659
90; 90; 90
5202.1Weber, 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 CIFLa10 O Se14I 41/a c d :215.9204; 15.9204; 21.0648
90; 90; 90
5339.1Weber, 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 CIFNd10 O Se14I 41/a c d :215.5983; 15.5983; 20.6291
90; 90; 90
5019.2Weber, 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 CIFO Pr10 Se14I 41/a c d :215.6874; 15.6874; 20.7342
90; 90; 90
5102.6Weber, 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 CIFC24 H32 I2 O8P -14.8499; 12.037; 12.804
64.561; 86.815; 83.893
671.1Walbaum, Christine; Pantenburg, Ingo; Meyer, Gerd
Iodine Molecules Included in the Structure of Dibenzo-24-Crown-8, (I2)@(db24c8)
Crystals, 2011, 1, 215-219
1508373 CIFC8 H15 N11 O8P -16.7224; 10.7473; 11.9604
113.212; 90.579; 99.815
779.68Deblitz, 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 CIFC15 H13 N3 O3P -16.8994; 9.8052; 11.1525
71.729; 79.436; 74.349
685.83Mamat, Constantin; Köckerling, Martin
The Synthesis and Molecular Structure of 2-(4-Methoxybenzyl)-4-nitro-2H-indazole
Crystals, 2012, 2, 176-181
1508380 CIFC54 H44 N2 O6 P2 S2P -19.859; 13.683; 9.664
105.04; 93.651; 110.735
1159.9Akutsu, 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 CIFC46 H42 N2 O9 S34P -16.742; 15.518; 18.034
74.29; 82.16; 80.36
1782.4Akutsu, 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 CIFC11 H14 O4P -18.5518; 10.8826; 11.9939
101.273; 98.287; 94.092
1077.54Khan, Imtiaz; Ibrar, Aliya; White, Jonathan M.
Ethyl 2,6-Dimethoxybenzoate: Synthesis, Spectroscopic and X-ray Crystallographic Analysis
Crystals, 2012, 2, 521-527
1508390 CIFC2 H4 Cu N8 O2P -17.4137; 7.489; 7.5391
118.928; 109.295; 92.47
335.18Joas, 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 CIFC20 H44 B4 Cu2 F16 N8 O4P -19.455; 12.0445; 16.493
87.469; 83.061; 75.465
1804.6Olguin, 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 CIFC5 H12 Br3 Cu2 NP -16.2948; 8.2624; 10.7612
75.964; 89.232; 84.072
540.04Komm, Theresa; Biner, Daniel; Neels, Antonia; Kramer, Karl W.
(C5H12N)Cu2Br3: A Piperidinium Copper(I) Bromide with [Cu2Br3]? Ladders
Crystals, 2012, 2, 1434-1440
1508423 CIFC14 H27.91 B18 Cl2.09 Co S8P -18.8565; 13.349; 14.654
106.617; 102.684; 98.963
1574.7Kazheva, 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 CIFC14 H27.75 B18 Br0.75 Cl1.25 Co S8P -18.7106; 13.441; 14.742
106.991; 101.784; 99.504
1568.6Kazheva, 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 CIFC36 H36.84 B18 Br1.16 Co O0.72 S32P -110.809; 16.187; 20.412
100.22; 100.43; 107.21
3252.1Kazheva, 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 CIFC8 H18 N12P -18.7982; 8.8927; 9.7756
67.827; 86.181; 71.794
671.68Laus, 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 CIFC4 H9 N5 SP -15.9032; 7.4591; 9.2538
113.598; 98.37; 99.017
358.88Laus, 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 CIFC6 H14 N6 OP -15.49; 8.4206; 10.3003
78.564; 85.796; 81.876
461.53Laus, 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 CIFC29 H21 N4 O2 S16P -117.3403; 20.1481; 23.9412
84.225; 69.596; 76.254
7613.6Benmansour, 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 CIFC29 H21 N4 O2 S16P -110.2496; 11.2314; 18.0649
96.525; 90.593; 115.397
1862.4Benmansour, 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 CIFC31 H24.5 Cl1.5 N4 O2 S16P -17.6688; 12.6432; 22.6204
98.43; 98.463; 106.246
2041.6Benmansour, 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 CIFC16 H5 Cl2 I N2 O2 S6P -17.0227; 12.676; 13.1732
62.169; 76.282; 78.615
1002.31Lieffrig, 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 CIFC26 H11 Cl2 I4 N3 O2 S12P -17.4173; 12.9354; 21.258
79.6; 85.564; 75.854
1944.1Lieffrig, 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 CIFC84 H152 N4 O32 W10P -110.7727; 11.3734; 23.982
98.566; 95.298; 116.168
2566.1Ito, 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 CIFC12 H11 O4.5 Re S6 Se2P -18.532; 9.75; 13.597
94.949; 94.723; 93.783
1120Furuta, 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 CIFC25 H22 Cl I6 S12 Se4P -17.893; 8.594; 34.646
89.481; 84.178; 77.788
2284.9Furuta, 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 CIFC14 H12 I3 S6 Se2P -18.443; 8.859; 16.686
84.118; 89.712; 68.365
1153.3Furuta, 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 CIFC30 H24 Cl5 N O Os S24P -17.6672; 9.8657; 17.9733
91.151; 93.636; 102.434
1324.2Zorina, 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 CIFC8 H7 N O5P -17.2831; 10.522; 11.41
83.38; 80.83; 82.02
851Fu, 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 CIFC8 H8 Br3 F6 N2 PP -18.2368; 13.4522; 13.6605
92.476; 100.965; 92.884
1481.96Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig
Halogen Interactions in 2,4,5-Tribromoimidazolium Salts
Crystals, 2012, 2, 1017-1033
1508476 CIFC9 H6 Br3 F6 N3 O4 S2P -17.5438; 8.6311; 15.9716
75.02; 87.083; 66.58
920.25Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig
Halogen Interactions in 2,4,5-Tribromoimidazolium Salts
Crystals, 2012, 2, 1017-1033
1508477 CIFC8 H8 Br5 F6 N2 PP -17.6729; 7.8858; 15.8383
90.001; 88.104; 62.169
846.88Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig
Halogen Interactions in 2,4,5-Tribromoimidazolium Salts
Crystals, 2012, 2, 1017-1033
1508478 CIFC8 H8 Br6 N2P -17.32; 11.5867; 18.1972
87.611; 81.121; 86.375
1521Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig
Halogen Interactions in 2,4,5-Tribromoimidazolium Salts
Crystals, 2012, 2, 1017-1033
1508483 CIFC17 H12.5 Cl0.5 F6 O P S4 Se4P -17.917; 10.582; 15.979
76.666; 89.916; 89.124
1302.4Ishidzu, 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 CIFC40 H30 Cl2 F12 P2 S10 Se8P -112.666; 14.299; 16.289
85.39; 88.219; 79.788
2893.6Ishidzu, 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 CIFC6 H10 N4 O6 SP -16.5611; 7.7322; 12.1134
97.82; 91.912; 113.295
556.62Laus, Gerhard; Kahlenberg, Volker
Crystal Structures of 1-Hydroxyimidazole and Its Salts
Crystals, 2012, 2, 1492-1501
1513838 CIFC21 H45 N12 O46.5 W10P -113.4905; 15.1707; 17.0692
79.594; 89.386; 70.001
3223.8Kulikov, Vladislav; Meyer, Gerd
Polyoxotungstates in Molecular Boxes of Purine Bases
Crystals, 2014, 4, 64
1540508 CIFC10 H18 O2P -14.1405; 15.2839; 17.7089
68.3291; 83.385; 85.0779
1033.39Sonneck, 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 CIFC26 H29 Br N2 O7 SP -18.3812; 13.0305; 13.2656
64.054; 83.078; 86.643
1293.2Mizoguchi, Kenji; Sakamoto, Hirokazu
Role ofWater Molecules to the Electronic States of M-DNA
Crystals, 2015, 5, 475
1548558 CIFC21 H26 Cd N4 O5P -19.2444; 10.0116; 14.4659
107.371; 91.269; 116.622
1123.1Marina Barsukova; Tatiana Goncharova; Denis Samsonenko; Danil Dybtsev; Andrei Potapov
Synthesis, Crystal Structure, and Luminescent Properties of New Zinc(II) and Cadmium(II) Metal-Organic Frameworks Based on Flexible Bis(imidazol-1-yl)alkane Ligands
Crystals, 2016, 6, 132
1558500 CIFC36 H20 Br3.77 Cl8 Cu2 N4P -17.8673; 11.0031; 11.7131
82.325; 89.994; 81.179
992.76Finocchio, Giada; Rizzato, Silvia; Macetti, Giovanni; Tusha, Gers; Lo Presti, Leonardo
Unravelling the Chemistry of the [Cu(4,7-Dichloroquinoline)2Br2]2 Dimeric Complex through Structural Analysis: A Borderline Ligand Field Case
Crystals, 2020, 10, 477
1563171 CIFC80 H92 Co5 N2 O48P -110.532; 13.2619; 18.1118
70.883; 74.056; 85.86
2297.9Lu, Bing-Bing; Han, Xue; Feng, Cheng-Jie; Wang, Duo; Ye, Fei
Two Co(II)-Based MOFs Constructed from Resorcin[4]Arene Ligand: Syntheses, Structures, and Heterogeneous Catalyst for Conversion of CO2
Crystals, 2021, 11, 574
1563172 CIFC82 H86 Co6 N2 O48P -111.2564; 15.9785; 16.5583
62.347; 73.527; 70.219
2453.6Lu, Bing-Bing; Han, Xue; Feng, Cheng-Jie; Wang, Duo; Ye, Fei
Two Co(II)-Based MOFs Constructed from Resorcin[4]Arene Ligand: Syntheses, Structures, and Heterogeneous Catalyst for Conversion of CO2
Crystals, 2021, 11, 574
1566038 CIFC56 H45 Cu F6 N2 O1.5 P3P -111.4728; 14.2115; 16.0992
92.018; 91.054; 112.546
2421.34Arnosti, Nina; Meyer, Marco; Prescimone, Alessandro; Constable, Edwin; Housecroft, Catherine
Heteroleptic [Cu(P^P)(N^N)][PF6] Complexes: Effects of Isomer Switching from 2,2′-biquinoline to 1,1′-biisoquinoline
Crystals, 2021, 11, 185
1566040 CIFC62 H40 F9 N4 O6 PrP -111.9059; 15.3694; 16.5675
79.097; 70.308; 67.575
2632.08Mautner, Franz A.; Bierbaumer, Florian; Fischer, Roland C.; Vicente, Ramon; Tubau, Ànnia; Ferran, Arnau; Massoud, Salah S.
Structural Characterization, Magnetic and Luminescent Properties of Praseodymium(III)-4,4,4-Trifluoro-1-(2-Naphthyl)Butane-1,3-Dionato(1-) Complexes
Crystals, 2021, 11, 179
1566043 CIFC28 H20 Cl N OP -16.9675; 7.6046; 20.706
83.02; 80.403; 83.126
1068.2Tan, Zeqing; Zhao, Jian; Sun, Jingzhi; Zhao, Jiaxin; He, Xinrui; Liu, Zhe; Zhu, Lin; Cheng, Xiao; Zhou, Chuanjian
CHCl3-Dependent Emission Color and Jumping Behavior of Cyclic Chalcone Single Crystals: The Halogen Bond Network Effect
Crystals, 2021, 11, 530
1566044 CIFC30 H22 Cl7 N OP -110.1961; 10.854; 14.091
84.387; 87.485; 84.125
1542.9Tan, Zeqing; Zhao, Jian; Sun, Jingzhi; Zhao, Jiaxin; He, Xinrui; Liu, Zhe; Zhu, Lin; Cheng, Xiao; Zhou, Chuanjian
CHCl3-Dependent Emission Color and Jumping Behavior of Cyclic Chalcone Single Crystals: The Halogen Bond Network Effect
Crystals, 2021, 11, 530
1567433 CIFC12 H14 N2 S2 SiP -19.7145; 11.5896; 12.9509
73.601; 89.903; 85.998
1395.13Seidel, 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
1567435 CIFC22 H18 N2 S2 SiP -19.4763; 10.2415; 11.1044
96.698; 114.442; 90.107
972.92Seidel, 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
1567438 CIFC29 H26 N2 S2 SiP -19.7034; 11.2023; 13.2853
73.607; 72.232; 82.511
1317.8Seidel, 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
1568591 CIFC10 H18 Ca O5P -15.8633; 6.8363; 16.0587
79.338; 81.318; 82.834
622.21Lopresti, Mattia; Milanesio, Marco; Palin, Luca
The Crystal Structure of Calcium Sebacate by X-ray Powder Diffraction Data
Crystals, 2023, 13, 261
1569035 CIFC10 H4 Br4 N2P -17.8725; 10.9122; 15.6053
103.034; 96.915; 92.46
1293.15Sakhapov, 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
1569037 CIFC15 H22 Br N S3P -18.0769; 8.5225; 12.5476
99.941; 96.608; 93.121
842.66Caltagirone, Claudia; Aragoni, Maria Carla; Arca, Massimiliano; Blake, Alexander John; Demartin, Francesco; Garau, Alessandra; Podda, Enrico; Pop, Alexandra; Lippolis, Vito; Silvestru, Cristian
Functionalization and Coordination Effects on the Structural Chemistry of Pendant Arm Derivatives of 1,4,7-trithia-10-aza-cyclododecane ([12]aneNS3)
Crystals, 2023, 13, 616
1569038 CIFC16 H23 Cl3 N2 O3 S3P -18.5163; 9.5058; 14.5582
73.29; 89.59; 85.96
1125.9Caltagirone, Claudia; Aragoni, Maria Carla; Arca, Massimiliano; Blake, Alexander John; Demartin, Francesco; Garau, Alessandra; Podda, Enrico; Pop, Alexandra; Lippolis, Vito; Silvestru, Cristian
Functionalization and Coordination Effects on the Structural Chemistry of Pendant Arm Derivatives of 1,4,7-trithia-10-aza-cyclododecane ([12]aneNS3)
Crystals, 2023, 13, 616
1569039 CIFC18 H23 Cl N2 O S3P -18.4811; 9.8093; 11.8739
99.469; 99.016; 93.623
958.31Caltagirone, Claudia; Aragoni, Maria Carla; Arca, Massimiliano; Blake, Alexander John; Demartin, Francesco; Garau, Alessandra; Podda, Enrico; Pop, Alexandra; Lippolis, Vito; Silvestru, Cristian
Functionalization and Coordination Effects on the Structural Chemistry of Pendant Arm Derivatives of 1,4,7-trithia-10-aza-cyclododecane ([12]aneNS3)
Crystals, 2023, 13, 616
1569441 CIFC10 H14 N6 SiP -18.6757; 8.874; 9.0989
64.211; 75.463; 79.194
608.08Herbig, Marcus; Kroke, Edwin; Wagler, Jörg
Molecular Structures and Intermolecular Hydrogen Bonding of Silylated 2-Aminopyrimidines
Crystals, 2023, 13, 990
1569442 CIFC30 H38 N18 O Si2P -110.064; 11.1921; 18.6757
72.898; 89; 63.346
1780.7Herbig, Marcus; Kroke, Edwin; Wagler, Jörg
Molecular Structures and Intermolecular Hydrogen Bonding of Silylated 2-Aminopyrimidines
Crystals, 2023, 13, 990
1569445 CIFC23 H17 Cl N4 SP -112.1537; 12.8679; 15.0994
70.272; 69.417; 67.402
1984.17Salama, Eid E.; Youssef, Mohamed F.; Boraei, Ahmed T. A.; Haukka, Matti; Soliman, Saied M.; Barakat, Assem; Sarhan, Ahmed A. M.
Base-Controlled Regiospecific Mono-Benzylation/Allylation and Diallylation of 4-Aryl-5-indolyl-1,2,4-triazole-3-thione: Thio-Aza Allyl Rearrangement
Crystals, 2023, 13, 992
1569806 CIFC92 H112 N2 O12 Zn3P -112.2791; 12.5594; 14.265
92.774; 115.24; 92.827
1981.6Lee, Dong Hee; An, Jaewook; Oh, Jihye; Park, In-Hyeok
Zinc(II) and Copper(II) Complexes of 4-Styrylpyridine and 1-Adamantanecarboxylic Acid: Syntheses, Crystal Structures, and Photopolymerization
Crystals, 2023, 13, 1226
1569807 CIFC124 H148 Cu3 N6 O14P -113.2103; 13.8734; 16.6325
102.709; 111.677; 92.99
2733.2Lee, Dong Hee; An, Jaewook; Oh, Jihye; Park, In-Hyeok
Zinc(II) and Copper(II) Complexes of 4-Styrylpyridine and 1-Adamantanecarboxylic Acid: Syntheses, Crystal Structures, and Photopolymerization
Crystals, 2023, 13, 1226
1569809 CIFC14 H17 Cd Cl N10 OP -19.323; 10.936; 11.312
112.637; 104.547; 105.133
944.1Soliman, Saied M.; Al-Rasheed, Hessa H.; AL-khamis, Sarah A.; Haukka, Matti; El-Faham, Ayman
X-ray Structures and Hirshfeld Studies of Two Dinuclear Cd(II) Complexes with a s-Triazine/Pyrazolo Ligand and Pesudohalides as a Linker
Crystals, 2023, 13, 1198
1569810 CIFC22 H17 Cl2 F6 N3 O3P -19.5129; 15.13; 17.615
72.469; 83.305; 89.077
2400.6Li, Guangyan; Wang, Ting; Huang, Xin; Wang, Na; Zhou, Lina; Tian, Beiqian; Feng, Ziwei; Liu, Ailing; Li, Yaling; Hao, Hongxun
Crystal Structure Analysis, Stability, Phase Transformation and Selective Nucleation Mechanism of Fluralaner Polymorphs
Crystals, 2023, 13, 1241
1570517 CIFC28 H32 Fe N12 NiP -18.8641; 10.0807; 10.235
106.771; 105.118; 103.206
798.42Kosuge, 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
1570518 CIFC44 H40 Fe N12 NiP -19.4355; 9.9756; 12.5092
98.322; 93.508; 115.15
1044.6Kosuge, 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
1570896 CIFC30 H43 Br2 Co N8 O8P -18.566; 9.831; 11.508
75.764; 79.755; 88.092
924.3Hu, Hong-Zhi; Yan, Yi-Bo; Wang, Na; Adila, Abuduheni; Liu, Yang; Liu, Zun-Qi
Phase Transition and Switchable Dielectric Properties of a Three-Dimensional Hydrogen-Bonding Framework Based on Cobalt (Ⅲ), o-Bromoaniline, and 18-Crown-6
Crystals, 2024, 14, 87
1570897 CIFC30 H43 Br2 Co N8 O8P -18.724; 9.687; 11.556
77.799; 78.954; 88.451
936.8Hu, Hong-Zhi; Yan, Yi-Bo; Wang, Na; Adila, Abuduheni; Liu, Yang; Liu, Zun-Qi
Phase Transition and Switchable Dielectric Properties of a Three-Dimensional Hydrogen-Bonding Framework Based on Cobalt (Ⅲ), o-Bromoaniline, and 18-Crown-6
Crystals, 2024, 14, 87
1571107 CIFC32 H16 Ga N8 O0.5P -17.848; 12.529; 12.72
91.03; 94.94; 89.98
1245.9Zugenmaier, Peter
Crystal and Molecular Structures of Two Phthalocyanines, Chloro(phthalocyaninato)gallium(III) (ClGaPc) and µ-Oxobis(phthalocyaninato)gallium(III) (PcGaOGaPc)
Crystals, 2024, 14, 182
1571112 CIFAl F5 Fe H14 O7P -16.4864; 8.719; 8.7917
103.834; 96.364; 95.4
476.05Seo, 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
1571113 CIFAl Co F5 H14 O7P -16.4434; 8.6691; 8.8031
104.019; 96.749; 95.254
470.08Seo, 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
1571114 CIFAl F5 H14 Ni O7P -16.4022; 8.5874; 8.7691
104.255; 96.638; 94.816
460.96Seo, 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
1571115 CIFC H8 Mg N2 O7 SP -15.214; 7.7014; 10.4275
68.758; 77.177; 71.498
367.38Nikolova, Rositsa; Kostov-Kytin, Vladislav; Petrova, Nadia; Kossev, Krasimir; Titorenkova, Rositsa; Velyanova, Gergana
New Data on Crystal Phases in the System MgSO4–OC(NH2)2–H2O
Crystals, 2024, 14, 227
1571385 CIFC33 H27 F4 Ir N4 O4.25P -112.0056; 13.9227; 21.5251
84.548; 81.768; 87.722
3543.5Stumbo, Emily E.; Hodge, Emarald K.; Williams, Matthew; Thornton, Diana A.; McMillen, Colin D.; Pienkos, Jared A.
Synthesis and Crystallographic Characterization of Heteroleptic Ir(III) Complexes Containing the N-oxide Functional Group and Crystallographic Characterization of Ir(III) N-oxide Precursors
Crystals, 2024, 14, 281
1571389 CIFC27 H15 F4 Ir N4 O2P -18.815; 12.0339; 22.3146
87.528; 79.542; 89.854
2325.6Stumbo, Emily E.; Hodge, Emarald K.; Williams, Matthew; Thornton, Diana A.; McMillen, Colin D.; Pienkos, Jared A.
Synthesis and Crystallographic Characterization of Heteroleptic Ir(III) Complexes Containing the N-oxide Functional Group and Crystallographic Characterization of Ir(III) N-oxide Precursors
Crystals, 2024, 14, 281
1571391 CIFC32.5 H24 Cl F10 Ir N6 O0.5 PP -113.8002; 14.3504; 17.3147
72.193; 89.145; 89.584
3264.3Stumbo, Emily E.; Hodge, Emarald K.; Williams, Matthew; Thornton, Diana A.; McMillen, Colin D.; Pienkos, Jared A.
Synthesis and Crystallographic Characterization of Heteroleptic Ir(III) Complexes Containing the N-oxide Functional Group and Crystallographic Characterization of Ir(III) N-oxide Precursors
Crystals, 2024, 14, 281
1571392 CIFC37 H32 Cl2 F10 Ir N6 PP -18.6227; 13.5061; 16.6738
104.272; 94.651; 90.132
1875.2Stumbo, Emily E.; Hodge, Emarald K.; Williams, Matthew; Thornton, Diana A.; McMillen, Colin D.; Pienkos, Jared A.
Synthesis and Crystallographic Characterization of Heteroleptic Ir(III) Complexes Containing the N-oxide Functional Group and Crystallographic Characterization of Ir(III) N-oxide Precursors
Crystals, 2024, 14, 281
1572292 CIFC17 H28 OP -113.1947; 13.6034; 18.7383
89.584; 76.961; 86.63
3270.94Iwanek (nee Wilczkowska), Ewa M.; Gliński, Marek
Study of the Influence of the Change from Methyl to Isopropyl Substituents in 1-(2,4,6-trialkylphenyl)ethanol on the Point Group Symmetry of the 0-D Hydrogen-Bonded Moiety
Crystals, 2024, 14, 642
1570054 CIFO25 P6 Pb10P -39.8109; 9.8109; 14.8403
90; 90; 120
1237.06Krivovichev, Sergey V.; Engel, Günther
The Crystal Structure of Pb10(PO4)6O Revisited: The Evidence of Superstructure
Crystals, 2023, 13, 1371
1572291 CIFC11 H16 OP -324.1786; 24.1786; 8.9518
90; 90; 120
4532.14Iwanek (nee Wilczkowska), Ewa M.; Gliński, Marek
Study of the Influence of the Change from Methyl to Isopropyl Substituents in 1-(2,4,6-trialkylphenyl)ethanol on the Point Group Symmetry of the 0-D Hydrogen-Bonded Moiety
Crystals, 2024, 14, 642
1508414 CIFCl6 Mo Na3P -3 1 c6.8712; 6.8712; 12.2531
90; 90; 120
501Beran, Martin; Meyer, Gerd
Crystal Structure of Na3MoCl6
Crystals, 2012, 1, 99-103
1570707 CIFK Na O4 SP -3 m 15.6914; 5.6914; 7.37
90; 90; 120
206.75Shablinskii, Andrey; Bubnova, Rimma; Shorets, Olga; Krzhizhanovskaya, Maria; Volkov, Sergey; Filatov, Stanislav
Novel High-Temperature Modification of Belomarinaite KNaSO4: Crystal Structure and Thermal Order–Disorder Phase Transitions
Crystals, 2023, 14, 27
1572519 CIFC12 H9 Co0.75 N2 O2P -4 21 c12.2559; 12.2559; 15.4132
90; 90; 90
2315.2Xiao, 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
1508399 CIFC56 H102.5 O50.75P 115.4039; 15.2813; 17.8904
99.662; 113.423; 102.481
3618.4Elasaad, Kossay; Alkhatib, Racha; Hennebelle, Thierry; Norberg, Bernadette; Wouters, Johan
Determination of the Absolute Configuration of Aegelinol by Crystallization of Its Inclusion Complex with beta-Cyclodextrin
Crystals, 2012, 2, 1441-1454
1544035 CIFC20 H14 N4 O2 S2P 15.3047; 9.4281; 10.3733
73.857; 79.443; 83.488
488.84Alpugan, Serkan; Ekineker, Gülçin; Ahsen, Vefa; Berber, Savaş; Önal, Emel; Dumoulin, Fabienne
Bisphthalonitrile with a Disulfide-Based Linker and its Dimethylene Analogue: Comparative Structural Insights
Crystals, 2016, 6, 89
1567434 CIFC22 H18 N2 O2 SiP 16.1626; 8.8822; 26.4639
88.692; 88.561; 81.453
1431.76Seidel, 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
3000295 CIFAg Cr P2 S6P 1 2/a 15.88318; 10.6214; 6.745
90; 106.043; 90
405.07Selter, Sebastian; Shemerliuk, Yuliia; Buechner, Bernd; Aswartham, Saicharan
Crystal Growth of the Quasi-2D Quarternary Compound Ag Cr P2 S6 by Chemical Vapor Transport
Crystals, 2021, 11, 500
1508382 CIFC20 H16 Br0.79 Cl1.21 Cu S16P 1 2/c 17.8124; 6.6564; 30.444
90; 96.062; 90
1574.3Kubo, Kazuya; Yamashita, Masahiro
New BEDT-TTF Radical Cation Salt with Mixed Anions: α'-[BEDT-TTF]2[CuBr2]0.4[CuCl2]0.6
Crystals, 2012, 2, 284-293
1567904 CIFC12 H40 F18 Fe4 N6 O2P 1 2/c 116.9178; 13.6023; 12.8848
90; 108.53; 90
2811.3Li, Teng; Lightfoot, Philip
Layered Hybrid iron Fluorides
Crystals, 2022, 12, 1443
1508366 CIFC15 H12 N2 O2 SP 1 21 19.9349; 6.3377; 10.5783
90; 97.752; 90
659.97Saeed, Aamer; ul Mahmood, Shams; Ishida, H.
Synthesis and Crystal Structure of 3-(4-Methoxyphenyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
Crystals, 2011, 1, 171-177
1508393 CIFC18 H18 N4 O3P 1 21 19.8152; 9.6305; 9.8465
90; 116.785; 90
830.88Lοser, Reik; Nieger, Martin; Gυtschow, Michael
Synthesis and Crystal Structure of Benzyl [(1S)-1-(5-amino-1,3,4-oxadiazol-2-yl)-2-phenylethyl]carbamate
Crystals, 2012, 2, 1201-1209
1540636 CIFC32 H34 Cu0 N4 O8 ZnP 1 21 111.421; 9.2213; 15.188
90; 106.112; 90
1536.7Tai, Xi-Shi; You, Hai-Ying
A New 1D Chained Coordination Polymer: Synthesis, Crystal Structure, Antitumor Activity and Luminescent Property
Crystals, 2015, 5, 608
1571116 CIFC H10 Mg N2 O8 SP 1 21 15.2452; 7.708; 10.23
90; 94.291; 90
412.44Nikolova, Rositsa; Kostov-Kytin, Vladislav; Petrova, Nadia; Kossev, Krasimir; Titorenkova, Rositsa; Velyanova, Gergana
New Data on Crystal Phases in the System MgSO4–OC(NH2)2–H2O
Crystals, 2024, 14, 227
1571387 CIFC30 H25 Cl4 Ir N4 O3P 1 21 19.3656; 16.9853; 9.5139
90; 91.2046; 90
1513.11Stumbo, Emily E.; Hodge, Emarald K.; Williams, Matthew; Thornton, Diana A.; McMillen, Colin D.; Pienkos, Jared A.
Synthesis and Crystallographic Characterization of Heteroleptic Ir(III) Complexes Containing the N-oxide Functional Group and Crystallographic Characterization of Ir(III) N-oxide Precursors
Crystals, 2024, 14, 281
1571388 CIFC30 H25 Cl4 Ir N4 O2P 1 21 19.3682; 16.9395; 9.4088
90; 91.347; 90
1492.69Stumbo, Emily E.; Hodge, Emarald K.; Williams, Matthew; Thornton, Diana A.; McMillen, Colin D.; Pienkos, Jared A.
Synthesis and Crystallographic Characterization of Heteroleptic Ir(III) Complexes Containing the N-oxide Functional Group and Crystallographic Characterization of Ir(III) N-oxide Precursors
Crystals, 2024, 14, 281
1508369 CIFC22 H23 N O5P 1 21/c 120.941; 8.7523; 21.2291
90; 93.529; 90
3883.5Petrov, Anna; Jones, Roderick C.; Vaughan, Douglas G.; Lough, Alan J.; Gossage, Robert A.
The Crystal and Molecular Structure of (2Z)-2-[3-(4-Methoxybenzoyl)-4,4-dimethyl-1,2-oxazolidin-2-ylidene]-1-(4-methoxyphenyl)ethanone
Crystals, 2011, 1, 229-235
1508374 CIFC15 H28 N2 O4P 1 21/c 18.4007; 16.4716; 12.4876
90; 90.948; 90
1727.71Mamat, Constantin; Flemming, Anke; Köckerling, Martin
Synthesis and Molecular Structure of tert-Butyl 4-(2-tert-butoxy-2-oxoethyl)piperazine-1-carboxylate
Crystals, 2012, 2, 90-95
1508378 CIFC5 H7 N5 O2 SP 1 21/c 18.0815; 10.0732; 10.7291
90; 100.383; 90
859.12Laus, 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
1508386 CIFC H8 Br N5 O3P 1 21/c 18.0261; 12.7412; 7.9296
90; 118.051; 90
715.64Khan, Imtiaz; Ibrar, Aliya; White, Jonathan M.
Inorganic Amino-Nitro-Guanidinium (ANQ) Derivatives
Crystals, 2012, 2, 675-689
1508392 CIFC5 H19 N2 O13 P3 Zn3P 1 21/c 111.3275; 8.3235; 18.588
90; 96.979; 90
1739.6Harrison, William T.A.; Currie, William R.
1,5-Diaminopentane As A Structure-Directing Agent for Zincophosphate Networks: Zn3(PO4)2(C5H14N2)2·3H2O and C5H16N2·Zn3(PO4)2(HPO4)·H2O
Crystals, 2012, 2, 974-983
1508395 CIFC11 H10 N2 O3P 1 21/c 19.5408; 9.5827; 11.58
90; 105.838; 90
1018.5Saeed, Aamer; Arshad, Ifzan; Florke, Ulrich
One-Pot Synthesis and Crystal Structure of Methyl 5-Hydroxy-1-phenyl-1H-pyrazole-3-carboxylate
Crystals, 2012, 2, 1248-1252
1508397 CIFC20 H44 B2 Cu2 F10 N8 O4P 1 21/c 110.4816; 7.0223; 22.732
90; 95.913; 90
1664.3Olguin, 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
1508401 CIFC23 H35 N O2 SP 1 21/c 110.7572; 9.7154; 20.5873
90; 90.003; 90
2151.59Laus, Gerhard; Kahlenberg, Volker; Richter, Frank; Nerdinger, Sven; Schottenberger, Herwig
Improved Synthesis and Crystal Structure of Dalcetrapib
Crystals, 2012, 2, 1455-1459
1508411 CIFAs7 Cs2 NaP 1 21/c 111.7671; 10.8528; 10.2115
90; 90.213; 90
1304.1Hua, He; Chauntae, Tyson; Svilen, Bobev
New Compounds with [As7]3- Clusters: Synthesis and Crystal Structures of the Zintl Phases Cs2NaAs7, Cs4ZnAs14 and Cs4CdAs14
Crystals, 2012, 1, 87-98
1508412 CIFAs14 Cd Cs4P 1 21/c 110.608; 16.761; 14.363
90; 91.785; 90
2552.5Hua, He; Chauntae, Tyson; Svilen, Bobev
New Compounds with [As7]3- Clusters: Synthesis and Crystal Structures of the Zintl Phases Cs2NaAs7, Cs4ZnAs14 and Cs4CdAs14
Crystals, 2012, 1, 87-98
1508413 CIFAs14 Cs4 ZnP 1 21/c 129.067; 10.4714; 43.039
90; 128.092; 90
10309.9Hua, He; Chauntae, Tyson; Svilen, Bobev
New Compounds with [As7]3- Clusters: Synthesis and Crystal Structures of the Zintl Phases Cs2NaAs7, Cs4ZnAs14 and Cs4CdAs14
Crystals, 2012, 1, 87-98
1508420 CIFC24 H20 N6 Ni O8P 1 21/c 119.032; 47.979; 17.596
90; 116.066; 90
14433.3Prior, Timothy J.; Rujiwatra, Apinpus; Chimupala, Yothin
[Ni(1,10-phenanthroline)2(H2O)2](NO3)2: A Simple Coordination Complex with a Remarkably Complicated Structure that Simplifies on Heating
Crystals, 2012, 1, 178-194
1508422 CIFC14 H20 Bi I5 O5P 1 21/c 113.7685; 11.7274; 17.0023
90; 115.197; 90
2484.1Fiolka, Christoph; Richter, Mark; Pantenburg, Ingo; Mudring, Anja-Verena; Meyer, Gerd
(B15c5)BiI3(I2): Molecular Benzo-15-Crown-5‒BiI3 Complexes Bridged by Iodine Molecules to Chains
Crystals, 2012, 1, 220-228
1508428 CIFC20 H58 N16 O8P 1 21/c 112.6856; 8.82; 31.3885
90; 99.39; 90
3464.91Laus, Gerhard; Kahlenberg, Volker; Wurst, Klaus; Hummel, Michael; Schottenberger, Herwig
1,4-Diazabicyclo[2.2.2]octane (DABCO) 5-aminotetrazolates
Crystals, 2012, 2, 96-104
1508429 CIFC7 H17 N7 OP 1 21/c 18.8064; 11.1285; 10.5456
90; 102.894; 90
1007.43Laus, Gerhard; Kahlenberg, Volker; Wurst, Klaus; Hummel, Michael; Schottenberger, Herwig
1,4-Diazabicyclo[2.2.2]octane (DABCO) 5-aminotetrazolates
Crystals, 2012, 2, 96-104
1508432 CIFC5 H12 N5 PP 1 21/c 15.9035; 13.388; 11.3173
90; 93.941; 90
892.4Laus, 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
1508460 CIFC40 H42 N6 O8P 1 21/c 112; 6.72; 24.4
90; 92.21; 90
1966.2Suzuki, Hideto; Akutsu, Hiroki; Yamada, Jun-ichi; Nakatsuji, Shinichi
Single-Component Charge-Transfer Crystals Based on Spin-Carrying TCNQ (7,7,8,8-Tetracyanoquinodimethane) Derivatives
Crystals, 2012, 2, 662-668
1508480 CIFC13 H12 Cl N O SP 1 21/c 110.6092; 10.8355; 11.1346
90; 98.643; 90
1265.45Open; Access; Kubicki, Maciej; Dutkiewicz, Grzegorz; Yathirajan, Hemmige S.; Dawar, Pankaj; Ramesha, Andagar R.; Dayananda, Alaloor S.
Crystal and Molecular Structures of Two 2-Aminothiophene Derivatives
Crystals, 2012, 2, 1058-1066
1508481 CIFC13 H12 Cl N O SP 1 21/c 110.3738; 10.8501; 11.8301
90; 98.615; 90
1316.53Open; Access; Kubicki, Maciej; Dutkiewicz, Grzegorz; Yathirajan, Hemmige S.; Dawar, Pankaj; Ramesha, Andagar R.; Dayananda, Alaloor S.
Crystal and Molecular Structures of Two 2-Aminothiophene Derivatives
Crystals, 2012, 2, 1058-1066
1508486 CIFC16 H13 F2 N3 SP 1 21/c 114.339; 11.1478; 9.541
90; 107.007; 90
1458.4Jasinski, 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
1508493 CIFC15 H13 Cl N2 O SP 1 21/c 115.6941; 10.7909; 8.6586
90; 102.184; 90
1433.33Dutkiewicz, Grzegorz; Kubicki, Maciej; Dayananda, Alaloor S.; Yathirajan, Hemmige S.; Ramesha, Andagar R.
Temperature-Dependent Ordering of the Methyl Group in the Crystal Structure of 5-(2-Chlorophenyl)-7-ethyl-1H-thieno [2,3-E][1,4]diazepin-2(3H)-one
Crystals, 2012, 2, 1347-1356
1508494 CIFC15 H13 Cl N2 O SP 1 21/c 115.5187; 10.9358; 8.8141
90; 101.245; 90
1467.12Dutkiewicz, Grzegorz; Kubicki, Maciej; Dayananda, Alaloor S.; Yathirajan, Hemmige S.; Ramesha, Andagar R.
Temperature-Dependent Ordering of the Methyl Group in the Crystal Structure of 5-(2-Chlorophenyl)-7-ethyl-1H-thieno [2,3-E][1,4]diazepin-2(3H)-one
Crystals, 2012, 2, 1347-1356
1508495 CIFC15 H13 Cl N2 O SP 1 21/c 115.1766; 11.2809; 8.9334
90; 98.726; 90
1511.7Dutkiewicz, Grzegorz; Kubicki, Maciej; Dayananda, Alaloor S.; Yathirajan, Hemmige S.; Ramesha, Andagar R.
Temperature-Dependent Ordering of the Methyl Group in the Crystal Structure of 5-(2-Chlorophenyl)-7-ethyl-1H-thieno [2,3-E][1,4]diazepin-2(3H)-one
Crystals, 2012, 2, 1347-1356
1508501 CIFC3 H10 Bi O11 S3P 1 21/c 111.601; 10.39; 10.498
90; 115.15; 90
1145.4Gschwind, Fabienne; Jansen, Martin
An Unusual Bismuth Ethanedisulfonate Network
Crystals, 2012, 2, 1374-1381
1513836 CIFC22 H37 N20 O41 W10P 1 21/c 114.477; 10.8678; 21.627
90; 122.78; 90
2860.8Kulikov, Vladislav; Meyer, Gerd
Polyoxotungstates in Molecular Boxes of Purine Bases
Crystals, 2014, 4, 64
1540507 CIFC9 H16 O2P 1 21/c 110.6473; 5.2855; 17.0313
90; 106.099; 90
920.87Sonneck, 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
1543243 CIFC10 H13 N O2P 1 21/c 19.3613; 9.3135; 11.8981
90; 102.497; 90
1012.8Baillargeon, Pierre; Caron-Duval, Édouard; Pellerin, Émilie; Gagné, Simon; Dory, Yves
Isomorphous Crystals from Diynes and Bromodiynes Involved in Hydrogen and Halogen Bonds
Crystals, 2016, 6, 37
1543244 CIFC10 H12 Br N O2P 1 21/c 110.4435; 9.209; 12.2744
90; 102.599; 90
1152.1Baillargeon, Pierre; Caron-Duval, Édouard; Pellerin, Émilie; Gagné, Simon; Dory, Yves
Isomorphous Crystals from Diynes and Bromodiynes Involved in Hydrogen and Halogen Bonds
Crystals, 2016, 6, 37
1548555 CIFC22 H27 N5 O5 ZnP 1 21/c 110.73257; 23.2562; 9.76351
90; 105.393; 90
2349.55Marina Barsukova; Tatiana Goncharova; Denis Samsonenko; Danil Dybtsev; Andrei Potapov
Synthesis, Crystal Structure, and Luminescent Properties of New Zinc(II) and Cadmium(II) Metal-Organic Frameworks Based on Flexible Bis(imidazol-1-yl)alkane Ligands
Crystals, 2016, 6, 132
1548556 CIFC22 H27 Cd N5 O5P 1 21/c 110.8546; 23.6261; 9.6799
90; 104.14; 90
2407.22Marina Barsukova; Tatiana Goncharova; Denis Samsonenko; Danil Dybtsev; Andrei Potapov
Synthesis, Crystal Structure, and Luminescent Properties of New Zinc(II) and Cadmium(II) Metal-Organic Frameworks Based on Flexible Bis(imidazol-1-yl)alkane Ligands
Crystals, 2016, 6, 132
1557475 CIFC16 H22 N2 O9 Rh2P 1 21/c 18.1042; 14.3559; 17.696
90; 103.077; 90
2005.4Arakawa, Kazuki; Yano, Natsumi; Imasaki, Nanako; Kohara, Yoshihiro; Yatsushiro, Daiki; Atarashi, Daiki; Handa, Makoto; Kataoka, Yusuke
Coordination-Induced Self-Assembly of a Heteroleptic Paddlewheel-Type Dirhodium Complex
Crystals, 2020, 10, 85
1559470 CIFC8 H16 N2 O4P 1 21/c 17.959; 7.154; 17.799
90; 91.68; 90
1013Destro, Riccardo; Roversi, Pietro; Soave, Raffaella; Hovestad, Arjan; Lo Presti, Leonardo
Experimental Charge Density Analysis and Electrostatic Properties of Crystalline 1,3-Bis(Dimethylamino)Squaraine and Its Dihydrate from Low Temperature (T = 18 and 20 K) XRD Data
Crystals, 2020, 10, 894
1559472 CIFC19 H16 O6P 1 21/c 112.0654; 11.0666; 23.955
90; 101.376; 90
3135.7Shin, Soon Young; Lee, Young Han; Lim, Yoongho; Lee, Ha Jin; Lee, Ji Hye; Yoo, Miri; Ahn, Seunghyun; Koh, Dongsoo
Single Crystal X-Ray Structure for the Disordered Two Independent Molecules of Novel Isoflavone: Synthesis, Hirshfeld Surface Analysis, Inhibition and Docking Studies on IKKβ of 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-6,7-dimethoxy-4H-chromen-4-one
Crystals, 2020, 10, 911
1566036 CIFCa3 Cs2 O16 S4P 1 21/c 19.9153; 9.376; 9.8044
90; 118.365; 90
802.04Fang, Penglin; Tang, Wenyue; Shen, Yaoguo; Hong, Jinquan; Li, Yongming; Jia, Junrong
Crystal Structure and Theoretical Analysis of Cs2Ca3(SO4)4
Crystals, 2022, 12, 126
1566039 CIFC44 H32 F9 O8 PrP 1 21/c 18.9307; 28.9448; 16.2421
90; 105.674; 90
4042.4Mautner, Franz A.; Bierbaumer, Florian; Fischer, Roland C.; Vicente, Ramon; Tubau, Ànnia; Ferran, Arnau; Massoud, Salah S.
Structural Characterization, Magnetic and Luminescent Properties of Praseodymium(III)-4,4,4-Trifluoro-1-(2-Naphthyl)Butane-1,3-Dionato(1-) Complexes
Crystals, 2021, 11, 179
1566041 CIFC54 H36 F9 N2 O8 PrP 1 21/c 113.2021; 14.6509; 24.8108
90; 98.938; 90
4740.7Mautner, Franz A.; Bierbaumer, Florian; Fischer, Roland C.; Vicente, Ramon; Tubau, Ànnia; Ferran, Arnau; Massoud, Salah S.
Structural Characterization, Magnetic and Luminescent Properties of Praseodymium(III)-4,4,4-Trifluoro-1-(2-Naphthyl)Butane-1,3-Dionato(1-) Complexes
Crystals, 2021, 11, 179
1567432 CIFC12 H14 N2 O2 SiP 1 21/c 112.7881; 10.7211; 18.6634
90; 90.247; 90
2558.8Seidel, 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
1567585 CIFC68 H48 Co N10 S2P 1 21/c 18.7148; 18.4121; 18.2547
90; 101.524; 90
2870.06Rocco, 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
1567587 CIFC73 H59 Cl9 Co N10 O2 S2P 1 21/c 114.7142; 9.842; 25.64
90; 94.944; 90
3699.3Rocco, 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
1569279 CIFC42 H28P 1 21/c 116.4311; 8.03; 11.2057
90; 104.651; 90
1430.43Sonina, Alina A.; Cheshkina, Darya S.; Kazantsev, Maxim S.
Additive-Assisted Crystallization of 9,10-Diphenylanthracene
Crystals, 2023, 13, 861
1569440 CIFC7 H13 N3 SiP 1 21/c 19.4337; 19.5412; 10.7349
90; 100.794; 90
1943.92Herbig, Marcus; Kroke, Edwin; Wagler, Jörg
Molecular Structures and Intermolecular Hydrogen Bonding of Silylated 2-Aminopyrimidines
Crystals, 2023, 13, 990
1569443 CIFC23 H24 N12 O SiP 1 21/c 115.9611; 21.1674; 22.6832
90; 97.74; 90
7593.81Herbig, Marcus; Kroke, Edwin; Wagler, Jörg
Molecular Structures and Intermolecular Hydrogen Bonding of Silylated 2-Aminopyrimidines
Crystals, 2023, 13, 990
1569444 CIFC22 H19 Cl N4 SP 1 21/c 111.0242; 16.5074; 11.0507
90; 97.688; 90
1992.94Salama, Eid E.; Youssef, Mohamed F.; Boraei, Ahmed T. A.; Haukka, Matti; Soliman, Saied M.; Barakat, Assem; Sarhan, Ahmed A. M.
Base-Controlled Regiospecific Mono-Benzylation/Allylation and Diallylation of 4-Aryl-5-indolyl-1,2,4-triazole-3-thione: Thio-Aza Allyl Rearrangement
Crystals, 2023, 13, 992
1569626 CIFC20 H28 Co O8 PbP 1 21/c 18.7792; 20.142; 13.72
90; 91.957; 90
2424.7Zhang, Yuxuan; Wei, Zheng; Dikarev, Evgeny V.
Synthesis, Structure, and Characterizations of a Heterobimetallic Heptanuclear Complex [Pb2Co5(acac)14]
Crystals, 2023, 13, 1089
1569627 CIFC70 H98 Co5 O28 Pb2P 1 21/c 123.8452; 10.7063; 16.3561
90; 97.096; 90
4143.63Zhang, Yuxuan; Wei, Zheng; Dikarev, Evgeny V.
Synthesis, Structure, and Characterizations of a Heterobimetallic Heptanuclear Complex [Pb2Co5(acac)14]
Crystals, 2023, 13, 1089
1569628 CIFC6 H6 Cl N O3P 1 21/c 112.648; 13.634; 8.574
90; 97.801; 90
1464.8Johnson, Aidan V.; Piedade, M. Fátima M.; Esteves, Catarina V.
pH-Dependent Crystallization of 2-, 4-, 5-, and 6-Hydroxynicotinic Acids in Aqueous Media
Crystals, 2023, 13, 1062

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