Crystallography Open Database

Result : There are 354 entries in the selection

You can download the COD numbers of the selection as a text file

You can download all files as a single ZIP archive

We are displaying first 300 results.

Searching journal of publication like 'Crystals'

COD ID: 1508363
CIF file Formula: - C94 H88 N24 Ni6 O19 S2 -
Comments: Zheng, Xiao-Feng; Zhu, Long-Guan An Unsymmetrical Trinickel Metal Complex with 4-Sulfobenzoate Axial Ligand: [Ni3(dpa)4(4-sb)(H2O)]x3H2O Crystals 1(3) (2011) 120-127
Space group: P b c n
Cell volume: 11276.4
Cell parameters: 15.525; 22.703; 31.993; 90; 90; 90;  

COD ID: 1508364
CIF file Formula: - C11 H13 N7 -
Comments: Dolzhenko, Anton V.; Tan, Geok Kheng; Koh, Lip Lin; Dolzhenko, Anna V.; Chui, Wai Keung Molecular and Crystal Structure of 7,7-Dimethyl-2-pyridin-4-yl-6,7-dihydro-1,2,4-triazolo[1,5-a][1,3,5]triazin-5-amine [1] Crystals 1(3) (2011) 136-144
Space group: P 1 21/n 1
Cell volume: 1189.06
Cell parameters: 7.3326; 19.4897; 8.6586; 90; 106.069; 90;  

COD ID: 1508365
CIF file Formula: - C21 H24 N2 O5 -
Comments: Alfonso, Ignacio; Bolte, Michael; Burguete, M. Isabel; Luis, Santiago V. Crystal Structure of the N-Benzyloxycarbonyl-alanyl-phenylalanyl-methyl Ester: The Importance of the H-Bonding Pattern Crystals 1(3) (2011) 163-170
Space group: P 21 21 21
Cell volume: 2008.3
Cell parameters: 5.0655; 8.4614; 46.856; 90; 90; 90;  

COD ID: 1508366
CIF file Formula: - C15 H12 N2 O2 S -
Comments: Saeed, Aamer; ul Mahmood, Shams; Ishida, H. Synthesis and Crystal Structure of 3-(4-Methoxyphenyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one Crystals 1(3) (2011) 171-177
Space group: P 1 21 1
Cell volume: 659.97
Cell parameters: 9.9349; 6.3377; 10.5783; 90; 97.752; 90;  

COD ID: 1508367
CIF file Formula: - C24 H32 I2 O8 -
Comments: Walbaum, Christine; Pantenburg, Ingo; Meyer, Gerd Iodine Molecules Included in the Structure of Dibenzo-24-Crown-8, (I2)@(db24c8) Crystals 1(4) (2011) 215-219
Space group: P -1
Cell volume: 671.1
Cell parameters: 4.8499; 12.037; 12.804; 64.561; 86.815; 83.893;  

COD ID: 1508369
CIF file Formula: - C22 H23 N O5 -
Comments: Petrov, 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 1(4) (2011) 229-235
Space group: P 1 21/c 1
Cell volume: 3883.5
Cell parameters: 20.941; 8.7523; 21.2291; 90; 93.529; 90;  

COD ID: 1508370
CIF file Formula: - C5 H19.47 N2 O5.24 P -
Comments: Harrison, William T. A. Supramolecular Hydrogen-Bond Motifs in Chiral and Racemic Molecular Salts: A Comparison of (S)-2-Methyl Piperizinium Hydrogen Phosphite Monohydrate, C5H14N2·HPO3·H2O and (R,S)-2-Methyl Piperizinium Hydrogen Phosphite 2.23 Hydrate, C5H14N2·HPO3·2.23H2O Crystals 1(4) (2011) 236-243
Space group: R -3 :H
Cell volume: 5174.5
Cell parameters: 31.075; 31.075; 6.1875; 90; 90; 120;  

COD ID: 1508371
CIF file Formula: - C5 H17 N2 O4 P -
Comments: Harrison, William T. A. Supramolecular Hydrogen-Bond Motifs in Chiral and Racemic Molecular Salts: A Comparison of (S)-2-Methyl Piperizinium Hydrogen Phosphite Monohydrate, C5H14N2 HPO3 H2O and (R,S)-2-Methyl Piperizinium Hydrogen Phosphite 2.23 Hydrate, C5H14N2 HPO3 2 23H2O Crystals 1(4) (2011) 236-243
Space group: P 21 21 21
Cell volume: 953.6
Cell parameters: 8.564; 9.593; 11.607; 90; 90; 90;  

COD ID: 1508372
CIF file Formula: - C14 H9 F N2 O S -
Comments: Saeed, Aamer; Flörke, Ulrich Synthesis and Crystal Structure of 1-(3-Fluorophenyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one Crystals 1(4) (2011) 254-259
Space group: P n a 21
Cell volume: 2471.2
Cell parameters: 22.43; 8.1478; 13.522; 90; 90; 90;  

COD ID: 1508373
CIF file Formula: - C8 H15 N11 O8 -
Comments: 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 2(1) (2012) 34-42
Space group: P -1
Cell volume: 779.68
Cell parameters: 6.7224; 10.7473; 11.9604; 113.212; 90.579; 99.815;  

COD ID: 1508374
CIF file Formula: - C15 H28 N2 O4 -
Comments: Mamat, Constantin; Flemming, Anke; Köckerling, Martin Synthesis and Molecular Structure of tert-Butyl 4-(2-tert-butoxy-2-oxoethyl)piperazine-1-carboxylate Crystals 2(1) (2012) 90-95
Space group: P 1 21/c 1
Cell volume: 1727.71
Cell parameters: 8.4007; 16.4716; 12.4876; 90; 90.948; 90;  

COD ID: 1508375
CIF file Formula: - C19 H26 O8 S -
Comments: Mamat, Constantin; Peppel, Tim; Köckerling, Martin The Molecular Structure of 1,2:5,6-Di-O-isopropylidene-3-O-toluenesulfonyl-α-D-glucofuranose Crystals 2(1) (2012) 105-109
Space group: P 21 21 21
Cell volume: 2127.4
Cell parameters: 9.7945; 10.1945; 21.306; 90; 90; 90;  

COD ID: 1508376
CIF file Formula: - C10 H24 Cl5 Fe N2 O4 -
Comments: Bäcker, Tobias; Mudring, Anja-Verena Betaine Chloride-Betaine Tetrachloridoferrate(III). An Ionic Liquid Related Crystal Structure Governed by the Pearson Concept Crystals 2(1) (2012) 110-117
Space group: P b c m
Cell volume: 2069.2
Cell parameters: 6.2717; 12.841; 25.693; 90; 90; 90;  

COD ID: 1508377
CIF file Formula: - C6 H10 B F4 N5 O2 S -
Comments: 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 2(1) (2012) 118-126
Space group: F d d 2
Cell volume: 10038
Cell parameters: 24.375; 30.163; 13.653; 90; 90; 90;  

COD ID: 1508378
CIF file Formula: - C5 H7 N5 O2 S -
Comments: 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 2(1) (2012) 118-126
Space group: P 1 21/c 1
Cell volume: 859.12
Cell parameters: 8.0815; 10.0732; 10.7291; 90; 100.383; 90;  

COD ID: 1508379
CIF file Formula: - C15 H13 N3 O3 -
Comments: Mamat, Constantin; Köckerling, Martin The Synthesis and Molecular Structure of 2-(4-Methoxybenzyl)-4-nitro-2H-indazole Crystals 2(2) (2012) 176-181
Space group: P -1
Cell volume: 685.83
Cell parameters: 6.8994; 9.8052; 11.1525; 71.729; 79.436; 74.349;  

COD ID: 1508380
CIF file Formula: - C54 H44 N2 O6 P2 S2 -
Comments: 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 2(2) (2012) 182-192
Space group: P -1
Cell volume: 1159.9
Cell parameters: 9.859; 13.683; 9.664; 105.04; 93.651; 110.735;  

COD ID: 1508381
CIF file Formula: - C46 H42 N2 O9 S34 -
Comments: 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 2(2) (2012) 182-192
Space group: P -1
Cell volume: 1782.4
Cell parameters: 6.742; 15.518; 18.034; 74.29; 82.16; 80.36;  

COD ID: 1508382
CIF file Formula: - C20 H16 Br0.79 Cl1.21 Cu S16 -
Comments: Kubo, Kazuya; Yamashita, Masahiro New BEDT-TTF Radical Cation Salt with Mixed Anions: α'-[BEDT-TTF]2[CuBr2]0.4[CuCl2]0.6 Crystals 2(2) (2012) 284-293
Space group: P 1 2/c 1
Cell volume: 1574.3
Cell parameters: 7.8124; 6.6564; 30.444; 90; 96.062; 90;  

COD ID: 1508383
CIF file Formula: - C35 H27 Cl2 N3 S12 Zn -
Comments: Nita, Gabriela; Branzea, Diana; Pop, Flavia; El-Ghayoury, Abdelkrim; Avarvari, Narcis Electroactive Bisiminopyridine Ligands: Synthesis and Complexation Studies Crystals 2(2) (2012) 338-348
Space group: C 1 2/c 1
Cell volume: 4203.3
Cell parameters: 11.8152; 10.1; 35.579; 90; 98.111; 90;  

COD ID: 1508384
CIF file Formula: - C20 H20 B0.5 N O -
Comments: 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 2(2) (2012) 446-465
Space group: C 1 2/c 1
Cell volume: 3048
Cell parameters: 21.4373; 6.1623; 23.2775; 90; 97.597; 90;  

COD ID: 1508385
CIF file Formula: - C11 H14 O4 -
Comments: Khan, Imtiaz; Ibrar, Aliya; White, Jonathan M. Ethyl 2,6-Dimethoxybenzoate: Synthesis, Spectroscopic and X-ray Crystallographic Analysis Crystals 2(2) (2012) 521-527
Space group: P -1
Cell volume: 1077.54
Cell parameters: 8.5518; 10.8826; 11.9939; 101.273; 98.287; 94.092;  

COD ID: 1508386
CIF file Formula: - C H8 Br N5 O3 -
Comments: Khan, Imtiaz; Ibrar, Aliya; White, Jonathan M. Inorganic Amino-Nitro-Guanidinium (ANQ) Derivatives Crystals 2(2) (2012) 675-689
Space group: P 1 21/c 1
Cell volume: 715.64
Cell parameters: 8.0261; 12.7412; 7.9296; 90; 118.051; 90;  

COD ID: 1508387
CIF file Formula: - Lu20 Ru11 -
Comments: Zimmermann, Sina; Pantenburg, Ingo; Meyer, Gerd Ru11Lu20, a New Intermetallic Compound with Eight- to Ten-Coordinate Ruthenium Atoms Crystals 2(2) (2012) 704-709
Space group: R -3 :H
Cell volume: 4056.1
Cell parameters: 12.5514; 12.5514; 29.73; 90; 90; 120;  

COD ID: 1508388
CIF file Formula: - C76 H56 Co2 K N20 O4 -
Comments: Tanaka, Yasuhiro; Ishikawa, Manabu; Watanabe, Naoko; Takahashi, Yukihiro; Naito, Toshio; Inabe, Tamotsu Metallic one-dimensional conductors composed of axially ligated (phthalocyanato)CoIII with supramolecular cations of A(EtOH)4 (A = Na and K) Crystals 2(3) (2012) 946-957
Space group: P 42/n :2
Cell volume: 3407.1
Cell parameters: 21.37; 21.37; 7.4607; 90; 90; 90;  

COD ID: 1508389
CIF file Formula: - C76 H56 Co2 N20 Na O4 -
Comments: Tanaka, Yasuhiro; Ishikawa, Manabu; Watanabe, Naoko; Takahashi, Yukihiro; Naito, Toshio; Inabe, Tamotsu Metallic one-dimensional conductors composed of axially ligated (phthalocyanato)CoIII with supramolecular cations of A(EtOH)4 (A = Na and K) Crystals 2(3) (2012) 946-957
Space group: P 42/n :2
Cell volume: 3320.5
Cell parameters: 21.163; 21.163; 7.414; 90; 90; 90;  

COD ID: 1508390
CIF file Formula: - C2 H4 Cu N8 O2 -
Comments: Joas, Manuel; Klapοtke, Thomas M.; Stierstorfer, Jοrg Preparation and Crystal Structure of Diaqua(?-5,5'-bistetrazolato-?4N1,N2,N5,N6)copper(II) Crystals 2(3) (2012) 958-966
Space group: P -1
Cell volume: 335.18
Cell parameters: 7.4137; 7.489; 7.5391; 118.928; 109.295; 92.47;  

COD ID: 1508391
CIF file Formula: - C18 H13 Cl N2 O4 -
Comments: Khan, Imtiaz; White, Jonathan M. Simple and Efficient One-Pot Synthesis, Spectroscopic Characterization and Crystal Structure of Methyl 5-(4-Chlorobenzoyloxy)-1-phenyl-1H-pyrazole-3-carboxylate Crystals 2(3) (2012) 967-973
Space group: P 21 21 21
Cell volume: 1621.2
Cell parameters: 6.6491; 7.9627; 30.621; 90; 90; 90;  

COD ID: 1508392
CIF file Formula: - C5 H19 N2 O13 P3 Zn3 -
Comments: Harrison, 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 2(3) (2012) 974-983
Space group: P 1 21/c 1
Cell volume: 1739.6
Cell parameters: 11.3275; 8.3235; 18.588; 90; 96.979; 90;  

COD ID: 1508393
CIF file Formula: - C18 H18 N4 O3 -
Comments: Lοser, 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 2(3) (2012) 1201-1209
Space group: P 1 21 1
Cell volume: 830.88
Cell parameters: 9.8152; 9.6305; 9.8465; 90; 116.785; 90;  

COD ID: 1508394
CIF file Formula: - C26 H24 O5 -
Comments: 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 2(3) (2012) 1239-1247
Space group: C 1 2/c 1
Cell volume: 4229.93
Cell parameters: 25.4114; 8.4744; 20.6921; 90; 108.328; 90;  

COD ID: 1508395
CIF file Formula: - C11 H10 N2 O3 -
Comments: Saeed, Aamer; Arshad, Ifzan; Florke, Ulrich One-Pot Synthesis and Crystal Structure of Methyl 5-Hydroxy-1-phenyl-1H-pyrazole-3-carboxylate Crystals 2(3) (2012) 1248-1252
Space group: P 1 21/c 1
Cell volume: 1018.5
Cell parameters: 9.5408; 9.5827; 11.58; 90; 105.838; 90;  

COD ID: 1508396
CIF file Formula: - C20 H44 B4 Cu2 F16 N8 O4 -
Comments: 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 2(3) (2012) 1357-1365
Space group: P -1
Cell volume: 1804.6
Cell parameters: 9.455; 12.0445; 16.493; 87.469; 83.061; 75.465;  

COD ID: 1508397
CIF file Formula: - C20 H44 B2 Cu2 F10 N8 O4 -
Comments: 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 2(3) (2012) 1357-1365
Space group: P 1 21/c 1
Cell volume: 1664.3
Cell parameters: 10.4816; 7.0223; 22.732; 90; 95.913; 90;  

COD ID: 1508398
CIF file Formula: - C5 H12 Br3 Cu2 N -
Comments: Komm, Theresa; Biner, Daniel; Neels, Antonia; Kramer, Karl W. (C5H12N)Cu2Br3: A Piperidinium Copper(I) Bromide with [Cu2Br3]? Ladders Crystals 2(4) (2012) 1434-1440
Space group: P -1
Cell volume: 540.04
Cell parameters: 6.2948; 8.2624; 10.7612; 75.964; 89.232; 84.072;  

COD ID: 1508399
CIF file Formula: - C56 H102.5 O50.75 -
Comments: Elasaad, 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 2(4) (2012) 1441-1454
Space group: P 1
Cell volume: 3618.4
Cell parameters: 15.4039; 15.2813; 17.8904; 99.662; 113.423; 102.481;  

COD ID: 1508400
CIF file Formula: - C14 H14 O4 -
Comments: Elasaad, 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 2(4) (2012) 1441-1454
Space group: P 21 21 21
Cell volume: 3542.2
Cell parameters: 6.8921; 11.4302; 44.964; 90; 90; 90;  

COD ID: 1508401
CIF file Formula: - C23 H35 N O2 S -
Comments: Laus, Gerhard; Kahlenberg, Volker; Richter, Frank; Nerdinger, Sven; Schottenberger, Herwig Improved Synthesis and Crystal Structure of Dalcetrapib Crystals 2(4) (2012) 1455-1459
Space group: P 1 21/c 1
Cell volume: 2151.59
Cell parameters: 10.7572; 9.7154; 20.5873; 90; 90.003; 90;  

COD ID: 1508403
CIF file Formula: - C25 H17 Mo N5 O3 -
Comments: Budge, Matthew G.; Muir, Kathleen J.; McQuillan, Geoffrey P.; Harrison, William T.A. Short Intramolecular N-H...C(carbonyl) Interactions in Mixed-Ligand Molybdenum Hexacarbonyl Derivatives Crystals 1(2) (2012) 47-58
Space group: P 1 21/n 1
Cell volume: 2285.31
Cell parameters: 11.0965; 13.0586; 16.6135; 90; 108.324; 90;  

COD ID: 1508404
CIF file Formula: - C31 H21 Mo N5 O3 -
Comments: Budge, Matthew G.; Muir, Kathleen J.; McQuillan, Geoffrey P.; Harrison, William T.A. Short Intramolecular N-H...C(carbonyl) Interactions in Mixed-Ligand Molybdenum Hexacarbonyl Derivatives Crystals 1(2) (2012) 47-58
Space group: P 1 21/n 1
Cell volume: 2613.9
Cell parameters: 11.4788; 19.073; 11.9881; 90; 95.179; 90;  

COD ID: 1508405
CIF file Formula: - C24 H19 Mo N5 O3 -
Comments: Budge, Matthew G.; Muir, Kathleen J.; McQuillan, Geoffrey P.; Harrison, William T.A. Short Intramolecular N-H...C(carbonyl) Interactions in Mixed-Ligand Molybdenum Hexacarbonyl Derivatives Crystals 1(2) (2012) 47-58
Space group: P 1 21/n 1
Cell volume: 2268.12
Cell parameters: 8.4222; 21.5966; 12.5011; 90; 94.065; 90;  

COD ID: 1508406
CIF file Formula: - C H2 Ba O5 P -
Comments: 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 1(2) (2012) 59-68
Space group: C 1 2/c 1
Cell volume: 986.1
Cell parameters: 12.3829; 7.9124; 11.0858; 90; 114.788; 90;  

COD ID: 1508407
CIF file Formula: - C10 H18 Ba N2 O18 -
Comments: 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 1(2) (2012) 59-68
Space group: C 1 2/m 1
Cell volume: 900.62
Cell parameters: 12.7393; 13.0111; 5.605; 90; 104.208; 90;  

COD ID: 1508408
CIF file Formula: - Ba Lu2 S4 -
Comments: Schurz, Christian M.; Schleid, Thomas Single Crystals of the Isotypic Series BaLu2Ch4 (Ch = S, Se and Te) with CaFe2O4-Type Structure Crystals 1(3) (2012) 78-86
Space group: P n m a
Cell volume: 684.2
Cell parameters: 12.1143; 3.9556; 14.2781; 90; 90; 90;  

COD ID: 1508409
CIF file Formula: - Ba Lu2 Se4 -
Comments: Schurz, Christian M.; Schleid, Thomas Single Crystals of the Isotypic Series BaLu2Ch4 (Ch = S, Se and Te) with CaFe2O4-Type Structure Crystals 1(3) (2012) 78-86
Space group: P n m a
Cell volume: 771.04
Cell parameters: 12.6132; 4.1089; 14.8774; 90; 90; 90;  

COD ID: 1508410
CIF file Formula: - Ba Lu2 Te4 -
Comments: Schurz, Christian M.; Schleid, Thomas Single Crystals of the Isotypic Series BaLu2Ch4 (Ch = S, Se and Te) with CaFe2O4-Type Structure Crystals 1(3) (2012) 78-86
Space group: P n m a
Cell volume: 945.82
Cell parameters: 13.5358; 4.3847; 15.9362; 90; 90; 90;  

COD ID: 1508411
CIF file Formula: - As7 Cs2 Na -
Comments: Hua, He; Chauntae, Tyson; Svilen, Bobev New Compounds with [As7]3- Clusters: Synthesis and Crystal Structures of the Zintl Phases Cs2NaAs7, Cs4ZnAs14 and Cs4CdAs14 Crystals 1(3) (2012) 87-98
Space group: P 1 21/c 1
Cell volume: 1304.1
Cell parameters: 11.7671; 10.8528; 10.2115; 90; 90.213; 90;  

COD ID: 1508412
CIF file Formula: - As14 Cd Cs4 -
Comments: Hua, He; Chauntae, Tyson; Svilen, Bobev New Compounds with [As7]3- Clusters: Synthesis and Crystal Structures of the Zintl Phases Cs2NaAs7, Cs4ZnAs14 and Cs4CdAs14 Crystals 1(3) (2012) 87-98
Space group: P 1 21/c 1
Cell volume: 2552.5
Cell parameters: 10.608; 16.761; 14.363; 90; 91.785; 90;  

COD ID: 1508413
CIF file Formula: - As14 Cs4 Zn -
Comments: Hua, He; Chauntae, Tyson; Svilen, Bobev New Compounds with [As7]3- Clusters: Synthesis and Crystal Structures of the Zintl Phases Cs2NaAs7, Cs4ZnAs14 and Cs4CdAs14 Crystals 1(3) (2012) 87-98
Space group: P 1 21/c 1
Cell volume: 10309.9
Cell parameters: 29.067; 10.4714; 43.039; 90; 128.092; 90;  

COD ID: 1508414
CIF file Formula: - Cl6 Mo Na3 -
Comments: Beran, Martin; Meyer, Gerd Crystal Structure of Na3MoCl6 Crystals 1(3) (2012) 99-103
Space group: P -3 1 c
Cell volume: 501
Cell parameters: 6.8712; 6.8712; 12.2531; 90; 90; 120;  

COD ID: 1508415
CIF file Formula: - Ba Sn3 -
Comments: Schαfer, Marion C.; Yamasaki, Yuki; Fritsch, Veronika; Bobev, Svilen Indium Doping in BaSn3-x Inx (0 <= x <= 0.2) with Ni3Sn Structure Crystals 1(3) (2012) 104-111
Space group: P 63/m m c
Cell volume: 247.44
Cell parameters: 7.2279; 7.2279; 5.469; 90; 90; 120;  

COD ID: 1508416
CIF file Formula: - Ba In0.2 Sn2.8 -
Comments: Schαfer, Marion C.; Yamasaki, Yuki; Fritsch, Veronika; Bobev, Svilen Indium Doping in BaSn3-x Inx (0 <= x <= 0.2) with Ni3Sn Structure Crystals 1(3) (2012) 104-111
Space group: P 63/m m c
Cell volume: 245.69
Cell parameters: 7.2604; 7.2604; 5.382; 90; 90; 120;  

COD ID: 1508417
CIF file Formula: - Ba Ga1.79 Sn4.21 -
Comments: 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 1(3) (2012) 145-162
Space group: C m c m
Cell volume: 799.06
Cell parameters: 4.5383; 12.2486; 14.3747; 90; 90; 90;  

COD ID: 1508418
CIF file Formula: - Ba8 Ga14.5 Sn31.5 -
Comments: 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 1(3) (2012) 145-162
Space group: P m -3 n
Cell volume: 1593.4
Cell parameters: 11.68; 11.68; 11.68; 90; 90; 90;  

COD ID: 1508419
CIF file Formula: - Ba8 Ga13.2 Sn32.8 -
Comments: 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 1(3) (2012) 145-162
Space group: I -4 3 m
Cell volume: 1554.57
Cell parameters: 11.5843; 11.5843; 11.5843; 90; 90; 90;  

COD ID: 1508420
CIF file Formula: - C24 H20 N6 Ni O8 -
Comments: Prior, 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 1(3) (2012) 178-194
Space group: P 1 21/c 1
Cell volume: 14433.3
Cell parameters: 19.032; 47.979; 17.596; 90; 116.066; 90;  

COD ID: 1508421
CIF file Formula: - Ba5 Cd2 O2 Sb4 -
Comments: Darone, Gregory M.; Bobev, Svilen Ba5Cd2Sb4O2, A New Antimonide Oxide with a Complex Structure Crystals 1(3) (2012) 206-214
Space group: C 1 2/m 1
Cell volume: 766.3
Cell parameters: 17.247; 4.9279; 12.24; 90; 132.558; 90;  

COD ID: 1508422
CIF file Formula: - C14 H20 Bi I5 O5 -
Comments: Fiolka, 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 1(4) (2012) 220-228
Space group: P 1 21/c 1
Cell volume: 2484.1
Cell parameters: 13.7685; 11.7274; 17.0023; 90; 115.197; 90;  

COD ID: 1508423
CIF file Formula: - C14 H27.91 B18 Cl2.09 Co S8 -
Comments: 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 2(1) (2012) 43-55
Space group: P -1
Cell volume: 1574.7
Cell parameters: 8.8565; 13.349; 14.654; 106.617; 102.684; 98.963;  

COD ID: 1508424
CIF file Formula: - C14 H27.75 B18 Br0.75 Cl1.25 Co S8 -
Comments: 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 2(1) (2012) 43-55
Space group: P -1
Cell volume: 1568.6
Cell parameters: 8.7106; 13.441; 14.742; 106.991; 101.784; 99.504;  

COD ID: 1508425
CIF file Formula: - C36 H36.84 B18 Br1.16 Co O0.72 S32 -
Comments: 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 2(1) (2012) 43-55
Space group: P -1
Cell volume: 3252.1
Cell parameters: 10.809; 16.187; 20.412; 100.22; 100.43; 107.21;  

COD ID: 1508426
CIF file Formula: - C8 H18 N12 -
Comments: Laus, Gerhard; Kahlenberg, Volker; Wurst, Klaus; Hummel, Michael; Schottenberger, Herwig 1,4-Diazabicyclo[2.2.2]octane (DABCO) 5-aminotetrazolates Crystals 2(1) (2012) 96-104
Space group: P -1
Cell volume: 671.68
Cell parameters: 8.7982; 8.8927; 9.7756; 67.827; 86.181; 71.794;  

COD ID: 1508427
CIF file Formula: - C7 H15 N7 -
Comments: Laus, Gerhard; Kahlenberg, Volker; Wurst, Klaus; Hummel, Michael; Schottenberger, Herwig 1,4-Diazabicyclo[2.2.2]octane (DABCO) 5-aminotetrazolates Crystals 2(1) (2012) 96-104
Space group: P b c a
Cell volume: 1907.73
Cell parameters: 5.9696; 16.7493; 19.0799; 90; 90; 90;  

COD ID: 1508428
CIF file Formula: - C20 H58 N16 O8 -
Comments: Laus, Gerhard; Kahlenberg, Volker; Wurst, Klaus; Hummel, Michael; Schottenberger, Herwig 1,4-Diazabicyclo[2.2.2]octane (DABCO) 5-aminotetrazolates Crystals 2(1) (2012) 96-104
Space group: P 1 21/c 1
Cell volume: 3464.91
Cell parameters: 12.6856; 8.82; 31.3885; 90; 99.39; 90;  

COD ID: 1508429
CIF file Formula: - C7 H17 N7 O -
Comments: Laus, Gerhard; Kahlenberg, Volker; Wurst, Klaus; Hummel, Michael; Schottenberger, Herwig 1,4-Diazabicyclo[2.2.2]octane (DABCO) 5-aminotetrazolates Crystals 2(1) (2012) 96-104
Space group: P 1 21/c 1
Cell volume: 1007.43
Cell parameters: 8.8064; 11.1285; 10.5456; 90; 102.894; 90;  

COD ID: 1508430
CIF file Formula: - C H3 Ag N6 -
Comments: 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 2(1) (2012) 127-136
Space group: C 1 2/c 1
Cell volume: 967.4
Cell parameters: 18.0338; 3.601; 14.906; 90; 91.94; 90;  

COD ID: 1508431
CIF file Formula: - C4 H9 N5 S -
Comments: 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 2(1) (2012) 127-136
Space group: P -1
Cell volume: 358.88
Cell parameters: 5.9032; 7.4591; 9.2538; 113.598; 98.37; 99.017;  

COD ID: 1508432
CIF file Formula: - C5 H12 N5 P -
Comments: 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 2(1) (2012) 127-136
Space group: P 1 21/c 1
Cell volume: 892.4
Cell parameters: 5.9035; 13.388; 11.3173; 90; 93.941; 90;  

COD ID: 1508433
CIF file Formula: - C4 H9 N5 O S -
Comments: 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 2(1) (2012) 127-136
Space group: P 1 21/n 1
Cell volume: 775.34
Cell parameters: 5.2452; 14.029; 10.7735; 90; 102.036; 90;  

COD ID: 1508434
CIF file Formula: - C6 H14 N6 O -
Comments: 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 2(1) (2012) 127-136
Space group: P -1
Cell volume: 461.53
Cell parameters: 5.49; 8.4206; 10.3003; 78.564; 85.796; 81.876;  

COD ID: 1508442
CIF file Formula: - As6 Ga Na10 Nb -
Comments: He, Hua; Tyson,Chauntae; Bobev, Svilen Synthesis and Crystal Structures of the Quaternary Zintl Phases RbNa8Ga3Pn6 (Pn = P, As) and Na10NbGaAs6 Crystals 2(2) (2012) 213-223
Space group: P 1 21/n 1
Cell volume: 847.58
Cell parameters: 8.3243; 7.5173; 13.5465; 90; 90.908; 90;  

COD ID: 1508443
CIF file Formula: - As6 Ga3 Na8 Rb -
Comments: He, Hua; Tyson,Chauntae; Bobev, Svilen Synthesis and Crystal Structures of the Quaternary Zintl Phases RbNa8Ga3Pn6 (Pn = P, As) and Na10NbGaAs6 Crystals 2(2) (2012) 213-223
Space group: P n m a
Cell volume: 1844.6
Cell parameters: 22.843; 4.7892; 16.861; 90; 90; 90;  

COD ID: 1508444
CIF file Formula: - Ga3 Na8 P6 Rb -
Comments: He, Hua; Tyson,Chauntae; Bobev, Svilen Synthesis and Crystal Structures of the Quaternary Zintl Phases RbNa8Ga3Pn6 (Pn = P, As) and Na10NbGaAs6 Crystals 2(2) (2012) 213-223
Space group: P n m a
Cell volume: 1710.5
Cell parameters: 22.276; 4.6947; 16.356; 90; 90; 90;  

COD ID: 1508445
CIF file Formula: - C27 H20 N3 O0.5 S16 -
Comments: Benmansour, Samia; Marchivie, Mathieu; Triki, Smail; Gomez-Garcia, Carlos J. Polymorphism and Metallic Behavior in BEDT-TTF Radical Salts with Polycyano Anions Crystals 2(2) (2012) 306-326
Space group: C 1 2/c 1
Cell volume: 7027.7
Cell parameters: 15.7423; 13.2947; 33.81; 90; 96.701; 90;  

COD ID: 1508446
CIF file Formula: - C25 H18 N3 O S16 -
Comments: Benmansour, Samia; Marchivie, Mathieu; Triki, Smail; Gomez-Garcia, Carlos J. Polymorphism and Metallic Behavior in BEDT-TTF Radical Salts with Polycyano Anions Crystals 2(2) (2012) 306-326
Space group: C 1 2/c 1
Cell volume: 6871.5
Cell parameters: 15.5152; 13.2644; 33.673; 90; 97.443; 90;  

COD ID: 1508447
CIF file Formula: - C29 H21 N4 O2 S16 -
Comments: Benmansour, Samia; Marchivie, Mathieu; Triki, Smail; Gomez-Garcia, Carlos J. Polymorphism and Metallic Behavior in BEDT-TTF Radical Salts with Polycyano Anions Crystals 2(2) (2012) 306-326
Space group: P -1
Cell volume: 7613.6
Cell parameters: 17.3403; 20.1481; 23.9412; 84.225; 69.596; 76.254;  

COD ID: 1508448
CIF file Formula: - C29 H21 N4 O2 S16 -
Comments: Benmansour, Samia; Marchivie, Mathieu; Triki, Smail; Gomez-Garcia, Carlos J. Polymorphism and Metallic Behavior in BEDT-TTF Radical Salts with Polycyano Anions Crystals 2(2) (2012) 306-326
Space group: P -1
Cell volume: 1862.4
Cell parameters: 10.2496; 11.2314; 18.0649; 96.525; 90.593; 115.397;  

COD ID: 1508449
CIF file Formula: - C31 H24.5 Cl1.5 N4 O2 S16 -
Comments: Benmansour, Samia; Marchivie, Mathieu; Triki, Smail; Gomez-Garcia, Carlos J. Polymorphism and Metallic Behavior in BEDT-TTF Radical Salts with Polycyano Anions Crystals 2(2) (2012) 306-326
Space group: P -1
Cell volume: 2041.6
Cell parameters: 7.6688; 12.6432; 22.6204; 98.43; 98.463; 106.246;  

COD ID: 1508450
CIF file Formula: - C16 H5 Cl2 I N2 O2 S6 -
Comments: Lieffrig, Julien; Jeannin, Olivier; Shin, Kyoung-Soon; Auban-Senzier, Pascale; Fourmigue, Marc Halogen Bonding Interactions in DDQ Charge Transfer Salts with Iodinated TTFs Crystals 2(2) (2012) 327-337
Space group: P -1
Cell volume: 1002.31
Cell parameters: 7.0227; 12.676; 13.1732; 62.169; 76.282; 78.615;  

COD ID: 1508451
CIF file Formula: - C26 H11 Cl2 I4 N3 O2 S12 -
Comments: Lieffrig, Julien; Jeannin, Olivier; Shin, Kyoung-Soon; Auban-Senzier, Pascale; Fourmigue, Marc Halogen Bonding Interactions in DDQ Charge Transfer Salts with Iodinated TTFs Crystals 2(2) (2012) 327-337
Space group: P -1
Cell volume: 1944.1
Cell parameters: 7.4173; 12.9354; 21.258; 79.6; 85.564; 75.854;  

COD ID: 1508452
CIF file Formula: - C84 H152 N4 O32 W10 -
Comments: Ito, Takeru; Fujimoto, Nozomu; Uchida, Sayaka; Iijima, Jun; Naruke, Haruo; Mizuno, Noritaka Polyoxotungstate-Surfactant Layered Crystal toward Conductive Inorganic-Organic Hybrid Crystals 2(2) (2012) 362-373
Space group: P -1
Cell volume: 2566.1
Cell parameters: 10.7727; 11.3734; 23.982; 98.566; 95.298; 116.168;  

COD ID: 1508453
CIF file Formula: - C16 H10 Au N4 S6 Se2 -
Comments: 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 2(2) (2012) 393-412
Space group: P n m a
Cell volume: 2225
Cell parameters: 42.054; 12.3735; 4.276; 90; 90; 90;  

COD ID: 1508454
CIF file Formula: - C12 H11 O4.5 Re S6 Se2 -
Comments: 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 2(2) (2012) 393-412
Space group: P -1
Cell volume: 1120
Cell parameters: 8.532; 9.75; 13.597; 94.949; 94.723; 93.783;  

COD ID: 1508455
CIF file Formula: - C25 H22 Cl I6 S12 Se4 -
Comments: 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 2(2) (2012) 393-412
Space group: P -1
Cell volume: 2284.9
Cell parameters: 7.893; 8.594; 34.646; 89.481; 84.178; 77.788;  

COD ID: 1508456
CIF file Formula: - C14 H12 I3 S6 Se2 -
Comments: 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 2(2) (2012) 393-412
Space group: P -1
Cell volume: 1153.3
Cell parameters: 8.443; 8.859; 16.686; 84.118; 89.712; 68.365;  

COD ID: 1508457
CIF file Formula: - C30 H24 Cl5 N O Os S24 -
Comments: 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 2(2) (2012) 627-642
Space group: P -1
Cell volume: 1324.2
Cell parameters: 7.6672; 9.8657; 17.9733; 91.151; 93.636; 102.434;  

COD ID: 1508458
CIF file Formula: - C36 H42 N6 O8 -
Comments: Suzuki, 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 2(2) (2012) 662-668
Space group: P 1 21/n 1
Cell volume: 1850.2
Cell parameters: 9.143; 19.352; 10.894; 90; 106.286; 90;  

COD ID: 1508459
CIF file Formula: - C36 H44 Cl4 N6 O8 -
Comments: Suzuki, 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 2(2) (2012) 662-668
Space group: P 1 21/n 1
Cell volume: 2058.3
Cell parameters: 12.89; 9.7; 16.89; 90; 102.92; 90;  

COD ID: 1508460
CIF file Formula: - C40 H42 N6 O8 -
Comments: Suzuki, 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 2(2) (2012) 662-668
Space group: P 1 21/c 1
Cell volume: 1966.2
Cell parameters: 12; 6.72; 24.4; 90; 92.21; 90;  

COD ID: 1508461
CIF file Formula: - C8 H7 N O5 -
Comments: Fu, Xin-Ling; Li, Jiang-Sheng; Simpson, Jim Non-Covalent Interactions in the Crystal Structure of Methyl 4-Hydroxy-3-Nitrobenzoate Crystals 2(2) (2012) 669-674
Space group: P -1
Cell volume: 851
Cell parameters: 7.2831; 10.522; 11.41; 83.38; 80.83; 82.02;  

COD ID: 1508462
CIF file Formula: - C16 H12 Pd2 S20 Sb -
Comments: 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 2(3) (2012) 861-874
Space group: C 1 2/c 1
Cell volume: 3355
Cell parameters: 14.325; 6.403; 36.893; 90; 97.543; 90;  

COD ID: 1508463
CIF file Formula: - C16 H12 P Pd2 S20 -
Comments: 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 2(3) (2012) 861-874
Space group: C 1 2/c 1
Cell volume: 3301.4
Cell parameters: 14.379; 6.3539; 36.496; 90; 98.07; 90;  

COD ID: 1508464
CIF file Formula: - C16 H12 As Pd2 S20 -
Comments: 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 2(3) (2012) 861-874
Space group: C 1 2/c 1
Cell volume: 3328.4
Cell parameters: 14.383; 6.3691; 36.672; 90; 97.793; 90;  

COD ID: 1508465
CIF file Formula: - C17 H14 Pd2 S20 Sb -
Comments: 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 2(3) (2012) 861-874
Space group: C 1 2/c 1
Cell volume: 3427.9
Cell parameters: 14.503; 6.3989; 37.244; 90; 97.352; 90;  

COD ID: 1508466
CIF file Formula: - C17 H14 P Pd2 S20 -
Comments: 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 2(3) (2012) 861-874
Space group: C 1 2/c 1
Cell volume: 3395.3
Cell parameters: 14.437; 6.3614; 37.243; 90; 96.938; 90;  

COD ID: 1508467
CIF file Formula: - C17 H14 As Pd2 S20 -
Comments: 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 2(3) (2012) 861-874
Space group: C 1 2/c 1
Cell volume: 3406.6
Cell parameters: 14.448; 6.3715; 37.282; 90; 96.973; 90;  

COD ID: 1508468
CIF file Formula: - C18 H16 Pd2 S20 Sb -
Comments: 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 2(3) (2012) 861-874
Space group: C 1 2/c 1
Cell volume: 3500
Cell parameters: 14.628; 6.4235; 37.577; 90; 97.577; 90;  

COD ID: 1508469
CIF file Formula: - C18 H16 P Pd2 S20 -
Comments: 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 2(3) (2012) 861-874
Space group: C 1 2/c 1
Cell volume: 3483
Cell parameters: 14.473; 6.3918; 37.859; 90; 96.009; 90;  

COD ID: 1508470
CIF file Formula: - C18 H16 As Pd2 S20 -
Comments: 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 2(3) (2012) 861-874
Space group: C 1 2/c 1
Cell volume: 3486.3
Cell parameters: 14.495; 6.4; 37.816; 90; 96.388; 90;  

COD ID: 1508471
CIF file Formula: - C8 H10 Br3 F6 N2 P -
Comments: Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig Halogen Interactions in 2,4,5-Tribromoimidazolium Salts Crystals 2(3) (2012) 1017-1033
Space group: P 1 21/n 1
Cell volume: 1496.11
Cell parameters: 7.5434; 15.5493; 12.7552; 90; 90.198; 90;  

COD ID: 1508472
CIF file Formula: - C7 H8 B Br3 F4 N2 -
Comments: Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig Halogen Interactions in 2,4,5-Tribromoimidazolium Salts Crystals 2(3) (2012) 1017-1033
Space group: I 41/a :2
Cell volume: 10503.8
Cell parameters: 23.6138; 23.6138; 18.8371; 90; 90; 90;  

COD ID: 1508473
CIF file Formula: - C6 H3 Br3 N2 -
Comments: Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig Halogen Interactions in 2,4,5-Tribromoimidazolium Salts Crystals 2(3) (2012) 1017-1033
Space group: P b c 21
Cell volume: 867.61
Cell parameters: 7.1109; 7.8014; 15.6397; 90; 90; 90;  

COD ID: 1508474
CIF file Formula: - C8 H8 Br3 F6 N2 P -
Comments: Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig Halogen Interactions in 2,4,5-Tribromoimidazolium Salts Crystals 2(3) (2012) 1017-1033
Space group: P -1
Cell volume: 1481.96
Cell parameters: 8.2368; 13.4522; 13.6605; 92.476; 100.965; 92.884;  

COD ID: 1508475
CIF file Formula: - C7 H6 B Br3 F4 N2 -
Comments: Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig Halogen Interactions in 2,4,5-Tribromoimidazolium Salts Crystals 2(3) (2012) 1017-1033
Space group: I 41/a :2
Cell volume: 10272.6
Cell parameters: 23.4674; 23.4674; 18.6531; 90; 90; 90;  

COD ID: 1508476
CIF file Formula: - C9 H6 Br3 F6 N3 O4 S2 -
Comments: Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig Halogen Interactions in 2,4,5-Tribromoimidazolium Salts Crystals 2(3) (2012) 1017-1033
Space group: P -1
Cell volume: 920.25
Cell parameters: 7.5438; 8.6311; 15.9716; 75.02; 87.083; 66.58;  

COD ID: 1508477
CIF file Formula: - C8 H8 Br5 F6 N2 P -
Comments: Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig Halogen Interactions in 2,4,5-Tribromoimidazolium Salts Crystals 2(3) (2012) 1017-1033
Space group: P -1
Cell volume: 846.88
Cell parameters: 7.6729; 7.8858; 15.8383; 90.001; 88.104; 62.169;  

COD ID: 1508478
CIF file Formula: - C8 H8 Br6 N2 -
Comments: Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig Halogen Interactions in 2,4,5-Tribromoimidazolium Salts Crystals 2(3) (2012) 1017-1033
Space group: P -1
Cell volume: 1521
Cell parameters: 7.32; 11.5867; 18.1972; 87.611; 81.121; 86.375;  

COD ID: 1508479
CIF file Formula: - C15 H15 N O S -
Comments: Open; 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 2(3) (2012) 1058-1066
Space group: P n a 21
Cell volume: 1343.08
Cell parameters: 9.208; 14.0485; 10.3826; 90; 90; 90;  

COD ID: 1508480
CIF file Formula: - C13 H12 Cl N O S -
Comments: Open; 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 2(3) (2012) 1058-1066
Space group: P 1 21/c 1
Cell volume: 1265.45
Cell parameters: 10.6092; 10.8355; 11.1346; 90; 98.643; 90;  

COD ID: 1508481
CIF file Formula: - C13 H12 Cl N O S -
Comments: Open; 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 2(3) (2012) 1058-1066
Space group: P 1 21/c 1
Cell volume: 1316.53
Cell parameters: 10.3738; 10.8501; 11.8301; 90; 98.615; 90;  

COD ID: 1508482
CIF file Formula: - C14 H10 O S4 Se4 -
Comments: 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 2(3) (2012) 1092-1107
Space group: P 1 21/n 1
Cell volume: 1821.4
Cell parameters: 5.2296; 11.006; 31.718; 90; 93.903; 90;  

COD ID: 1508483
CIF file Formula: - C17 H12.5 Cl0.5 F6 O P S4 Se4 -
Comments: 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 2(3) (2012) 1092-1107
Space group: P -1
Cell volume: 1302.4
Cell parameters: 7.917; 10.582; 15.979; 76.666; 89.916; 89.124;  

COD ID: 1508484
CIF file Formula: - C40 H30 Cl2 F12 P2 S10 Se8 -
Comments: 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 2(3) (2012) 1092-1107
Space group: P -1
Cell volume: 2893.6
Cell parameters: 12.666; 14.299; 16.289; 85.39; 88.219; 79.788;  

COD ID: 1508485
CIF file Formula: - C16 H13 F2 N3 O -
Comments: 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 2(3) (2012) 1108-1115
Space group: C 1 2/c 1
Cell volume: 2862.11
Cell parameters: 17.6219; 10.8735; 15.3216; 90; 102.864; 90;  

COD ID: 1508486
CIF file Formula: - C16 H13 F2 N3 S -
Comments: 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 2(3) (2012) 1108-1115
Space group: P 1 21/c 1
Cell volume: 1458.4
Cell parameters: 14.339; 11.1478; 9.541; 90; 107.007; 90;  

COD ID: 1508487
CIF file Formula: - Ce10 O Se14 -
Comments: 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 2(3) (2012) 1136-1145
Space group: I 41/a c d :2
Cell volume: 5202.1
Cell parameters: 15.7896; 15.7896; 20.8659; 90; 90; 90;  

COD ID: 1508488
CIF file Formula: - La10 O Se14 -
Comments: 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 2(3) (2012) 1136-1145
Space group: I 41/a c d :2
Cell volume: 5339.1
Cell parameters: 15.9204; 15.9204; 21.0648; 90; 90; 90;  

COD ID: 1508489
CIF file Formula: - Nd10 O Se14 -
Comments: 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 2(3) (2012) 1136-1145
Space group: I 41/a c d :2
Cell volume: 5019.2
Cell parameters: 15.5983; 15.5983; 20.6291; 90; 90; 90;  

COD ID: 1508490
CIF file Formula: - O Pr10 Se14 -
Comments: 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 2(3) (2012) 1136-1145
Space group: I 41/a c d :2
Cell volume: 5102.6
Cell parameters: 15.6874; 15.6874; 20.7342; 90; 90; 90;  

COD ID: 1508491
CIF file Formula: - C12 H10 Au0.94 Cl1.88 N2 S6 -
Comments: 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 2(3) (2012) 1283-1290
Space group: I -4 2 d
Cell volume: 3625.26
Cell parameters: 7.3259; 7.3259; 67.5487; 90; 90; 90;  

COD ID: 1508492
CIF file Formula: - C12 H10 Au0.94 Cl1.88 N2 S6 -
Comments: 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 2(3) (2012) 1283-1290
Space group: I -4 2 d
Cell volume: 3596.74
Cell parameters: 7.3066; 7.3066; 67.3719; 90; 90; 90;  

COD ID: 1508493
CIF file Formula: - C15 H13 Cl N2 O S -
Comments: Dutkiewicz, 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 2(3) (2012) 1347-1356
Space group: P 1 21/c 1
Cell volume: 1433.33
Cell parameters: 15.6941; 10.7909; 8.6586; 90; 102.184; 90;  

COD ID: 1508494
CIF file Formula: - C15 H13 Cl N2 O S -
Comments: Dutkiewicz, 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 2(3) (2012) 1347-1356
Space group: P 1 21/c 1
Cell volume: 1467.12
Cell parameters: 15.5187; 10.9358; 8.8141; 90; 101.245; 90;  

COD ID: 1508495
CIF file Formula: - C15 H13 Cl N2 O S -
Comments: Dutkiewicz, 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 2(3) (2012) 1347-1356
Space group: P 1 21/c 1
Cell volume: 1511.7
Cell parameters: 15.1766; 11.2809; 8.9334; 90; 98.726; 90;  

COD ID: 1508496
CIF file Formula: - C3 H4 N2 O -
Comments: Laus, Gerhard; Kahlenberg, Volker Crystal Structures of 1-Hydroxyimidazole and Its Salts Crystals 2(4) (2012) 1492-1501
Space group: P 21 21 21
Cell volume: 393.75
Cell parameters: 5.1024; 8.2922; 9.3064; 90; 90; 90;  

COD ID: 1508497
CIF file Formula: - C3 H5 Cl N2 O -
Comments: Laus, Gerhard; Kahlenberg, Volker Crystal Structures of 1-Hydroxyimidazole and Its Salts Crystals 2(4) (2012) 1492-1501
Space group: P 1 21/n 1
Cell volume: 502.96
Cell parameters: 4.2693; 10.7541; 10.9756; 90; 93.535; 90;  

COD ID: 1508498
CIF file Formula: - C3 H5 Br N2 O -
Comments: Laus, Gerhard; Kahlenberg, Volker Crystal Structures of 1-Hydroxyimidazole and Its Salts Crystals 2(4) (2012) 1492-1501
Space group: P 1 21/n 1
Cell volume: 545.07
Cell parameters: 4.4182; 11.0416; 11.2015; 90; 94.081; 90;  

COD ID: 1508499
CIF file Formula: - C6 H10 N4 O6 S -
Comments: Laus, Gerhard; Kahlenberg, Volker Crystal Structures of 1-Hydroxyimidazole and Its Salts Crystals 2(4) (2012) 1492-1501
Space group: P -1
Cell volume: 556.62
Cell parameters: 6.5611; 7.7322; 12.1134; 97.82; 91.912; 113.295;  

COD ID: 1508500
CIF file Formula: - C3 H5 N3 O4 -
Comments: Laus, Gerhard; Kahlenberg, Volker Crystal Structures of 1-Hydroxyimidazole and Its Salts Crystals 2(4) (2012) 1492-1501
Space group: C 1 c 1
Cell volume: 568.26
Cell parameters: 3.6216; 17.385; 9.0259; 90; 90.499; 90;  

COD ID: 1508501
CIF file Formula: - C3 H10 Bi O11 S3 -
Comments: Gschwind, Fabienne; Jansen, Martin An Unusual Bismuth Ethanedisulfonate Network Crystals 2(4) (2012) 1374-1381
Space group: P 1 21/c 1
Cell volume: 1145.4
Cell parameters: 11.601; 10.39; 10.498; 90; 115.15; 90;  

COD ID: 1513836
CIF file Formula: - C22 H37 N20 O41 W10 -
Comments: Kulikov, Vladislav; Meyer, Gerd Polyoxotungstates in Molecular Boxes of Purine Bases Crystals 4(1) (2014) 64
Space group: P 1 21/c 1
Cell volume: 2860.8
Cell parameters: 14.477; 10.8678; 21.627; 90; 122.78; 90;  

COD ID: 1513837
CIF file Formula: - C14 H22 N8 O25 W6 -
Comments: Kulikov, Vladislav; Meyer, Gerd Polyoxotungstates in Molecular Boxes of Purine Bases Crystals 4(1) (2014) 64
Space group: C 1 2/c 1
Cell volume: 3237.1
Cell parameters: 16.81; 13.0514; 15.675; 90; 109.73; 90;  

COD ID: 1513838
CIF file Formula: - C21 H45 N12 O46.5 W10 -
Comments: Kulikov, Vladislav; Meyer, Gerd Polyoxotungstates in Molecular Boxes of Purine Bases Crystals 4(1) (2014) 64
Space group: P -1
Cell volume: 3223.8
Cell parameters: 13.4905; 15.1707; 17.0692; 79.594; 89.386; 70.001;  

COD ID: 1518356
CIF file Formula: - C2 H13 Co N4 O9 -
Comments: Hrib, Cristian; Blaurock, Steffen; Edelmann, Frank Crystallization and Structure Determination of Fac-Triammin-Aquo-Oxalato-Cobalt (III)-Nitrate Monohydrate Crystals 4(4) (2014) 490
Space group: P 1 21/n 1
Cell volume: 1000.4
Cell parameters: 7.8532; 10; 13.192; 90; 105.06; 90;  

COD ID: 1520321
CIF file Formula: - B Ga O3 -
Comments: Wang, Shichao; Ye, Ning; Poeppelmeier, Kenneth Flux Growth and Crystal Structure Refinement of Calcite Type Borate GaBO3 Crystals 5(2) (2015) 252
Space group: R -3 c :H
Cell volume: 255.947
Cell parameters: 4.5659; 4.5659; 14.1764; 90; 90; 120;  

COD ID: 1529351
CIF file Formula: - C4 H48 K0.28 N16 Ni2 O4 Rb7.72 Si18 -
Comments: 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 5(3) (2015) 275
Space group: C 1 2/c 1
Cell volume: 5680
Cell parameters: 30.669; 9.919; 19.894; 90; 110.18; 90;  

COD ID: 1529352
CIF file Formula: - C20 H9 N3 O9 S4 -
Comments: Salmerón-Valverde, Amparo; Bernès, Sylvain Two Closely Related Organic Charge-Transfer Complexes Based on Tetrathiafulvalene and 9H-fluorenone Derivatives. Competition between Hydrogen Bonding and Stacking Interactions Crystals 5(3) (2015) 283
Space group: P 1 21/n 1
Cell volume: 2208
Cell parameters: 8.0275; 7.8676; 34.961; 90; 90.106; 90;  

COD ID: 1529353
CIF file Formula: - C21 H11 N3 O9 S4 -
Comments: Salmerón-Valverde, Amparo; Bernès, Sylvain Two Closely Related Organic Charge-Transfer Complexes Based on Tetrathiafulvalene and 9H-fluorenone Derivatives. Competition between Hydrogen Bonding and Stacking Interactions Crystals 5(3) (2015) 283
Space group: P 1 21/n 1
Cell volume: 2364
Cell parameters: 19.078; 7.2068; 19.443; 90; 117.833; 90;  

COD ID: 1540501
CIF file Formula: - As3 Ga Sr3 -
Comments: 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 5(4) (2015) 433
Space group: P n m a
Cell volume: 1598.4
Cell parameters: 12.757; 19.268; 6.503; 90; 90; 90;  

COD ID: 1540502
CIF file Formula: - Al As3 Ba3 -
Comments: 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 5(4) (2015) 433
Space group: C m c e
Cell volume: 1810.3
Cell parameters: 19.854; 6.8636; 13.2849; 90; 90; 90;  

COD ID: 1540503
CIF file Formula: - As3 Ba3 Ga -
Comments: 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 5(4) (2015) 433
Space group: P n m a
Cell volume: 1815.1
Cell parameters: 13.3589; 19.9788; 6.8008; 90; 90; 90;  

COD ID: 1540504
CIF file Formula: - Al Ba3 P3 -
Comments: 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 5(4) (2015) 433
Space group: C m c e
Cell volume: 1693.1
Cell parameters: 19.3572; 6.7433; 12.9707; 90; 90; 90;  

COD ID: 1540505
CIF file Formula: - Ga P3 Sr3 -
Comments: 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 5(4) (2015) 433
Space group: C m c e
Cell volume: 1488.2
Cell parameters: 18.787; 6.3867; 12.403; 90; 90; 90;  

COD ID: 1540506
CIF file Formula: - Al As3 Sr3 -
Comments: 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 5(4) (2015) 433
Space group: C m c e
Cell volume: 1595
Cell parameters: 19.149; 6.5652; 12.6871; 90; 90; 90;  

COD ID: 1540507
CIF file Formula: - C9 H16 O2 -
Comments: 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 5(4) (2015) 466
Space group: P 1 21/c 1
Cell volume: 920.87
Cell parameters: 10.6473; 5.2855; 17.0313; 90; 106.099; 90;  

COD ID: 1540508
CIF file Formula: - C10 H18 O2 -
Comments: 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 5(4) (2015) 466
Space group: P -1
Cell volume: 1033.39
Cell parameters: 4.1405; 15.2839; 17.7089; 68.3291; 83.385; 85.0779;  

COD ID: 1540509
CIF file Formula: - C24 H26 Ca N4 O14 S2 -
Comments: Tai, Xi-Shi; Wang, Xin Synthesis and Crystal Structure of a 1D Chained Coordination Polymer Constructed from Ca2+ and 2-[(E)-(2-Furoylhydrazono)methyl]benzenesulfonate Crystals 5(4) (2015) 458
Space group: P 21 21 2
Cell volume: 1559.3
Cell parameters: 16.355; 17.478; 5.4549; 90; 90; 90;  

COD ID: 1540633
CIF file Formula: - C26 H31 Br N2 O7 S -
Comments: Mizoguchi, Kenji; Sakamoto, Hirokazu Role ofWater Molecules to the Electronic States of M-DNA Crystals 5(4) (2015) 475
Space group: P 1 21/n 1
Cell volume: 2702.6
Cell parameters: 10.418; 14.7052; 17.8673; 90; 99.129; 90;  

COD ID: 1540634
CIF file Formula: - C26 H29 Br N2 O7 S -
Comments: Mizoguchi, Kenji; Sakamoto, Hirokazu Role ofWater Molecules to the Electronic States of M-DNA Crystals 5(4) (2015) 475
Space group: P -1
Cell volume: 1293.2
Cell parameters: 8.3812; 13.0305; 13.2656; 64.054; 83.078; 86.643;  

COD ID: 1540635
CIF file Formula: - C48 H54 Br2 N4 O10 S2 -
Comments: Mizoguchi, Kenji; Sakamoto, Hirokazu Role ofWater Molecules to the Electronic States of M-DNA Crystals 5(4) (2015) 475
Space group: P 1 21/n 1
Cell volume: 4822
Cell parameters: 15.9728; 14.008; 22.8933; 90; 109.716; 90;  

COD ID: 1540636
CIF file Formula: - C32 H34 Cu0 N4 O8 Zn -
Comments: Tai, Xi-Shi; You, Hai-Ying A New 1D Chained Coordination Polymer: Synthesis, Crystal Structure, Antitumor Activity and Luminescent Property Crystals 5(4) (2015) 608
Space group: P 1 21 1
Cell volume: 1536.7
Cell parameters: 11.421; 9.2213; 15.188; 90; 106.112; 90;  

COD ID: 1543243
CIF file Formula: - C10 H13 N O2 -
Comments: Baillargeon, Pierre; Caron-Duval, Édouard; Pellerin, Émilie; Gagné, Simon; Dory, Yves Isomorphous Crystals from Diynes and Bromodiynes Involved in Hydrogen and Halogen Bonds Crystals 6(4) (2016) 37
Space group: P 1 21/c 1
Cell volume: 1012.8
Cell parameters: 9.3613; 9.3135; 11.8981; 90; 102.497; 90;  

COD ID: 1543244
CIF file Formula: - C10 H12 Br N O2 -
Comments: Baillargeon, Pierre; Caron-Duval, Édouard; Pellerin, Émilie; Gagné, Simon; Dory, Yves Isomorphous Crystals from Diynes and Bromodiynes Involved in Hydrogen and Halogen Bonds Crystals 6(4) (2016) 37
Space group: P 1 21/c 1
Cell volume: 1152.1
Cell parameters: 10.4435; 9.209; 12.2744; 90; 102.599; 90;  

COD ID: 1544035
CIF file Formula: - C20 H14 N4 O2 S2 -
Comments: Alpugan, 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 6(8) (2016) 89
Space group: P 1
Cell volume: 488.84
Cell parameters: 5.3047; 9.4281; 10.3733; 73.857; 79.443; 83.488;  

COD ID: 1546797
CIF file Formula: - C9 H11 O -
Comments: James A. Kaduk; Amy M. Gindhart; Thomas N. Blanton Crystal Structure of 17alpha-Dihydroequilin, C18H22O2, from Synchrotron Powder Diffraction Data and Density Functional Theory Crystals 7 (2017) 218
Space group: P 21 21 21
Cell volume: 1419.92
Cell parameters: 6.768729; 8.96849; 23.39031; 90; 90; 90;  

COD ID: 1548555
CIF file Formula: - C22 H27 N5 O5 Zn -
Comments: Marina 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 6 (2016) 132
Space group: P 1 21/c 1
Cell volume: 2349.55
Cell parameters: 10.73257; 23.2562; 9.76351; 90; 105.393; 90;  

COD ID: 1548556
CIF file Formula: - C22 H27 Cd N5 O5 -
Comments: Marina 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 6 (2016) 132
Space group: P 1 21/c 1
Cell volume: 2407.22
Cell parameters: 10.8546; 23.6261; 9.6799; 90; 104.14; 90;  

COD ID: 1548557
CIF file Formula: - C20 H22 N4 O4 Zn -
Comments: Marina 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 6 (2016) 132
Space group: P 21 21 21
Cell volume: 5893
Cell parameters: 15.123; 18.806; 20.722; 90; 90; 90;  

COD ID: 1548558
CIF file Formula: - C21 H26 Cd N4 O5 -
Comments: Marina 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 6 (2016) 132
Space group: P -1
Cell volume: 1123.1
Cell parameters: 9.2444; 10.0116; 14.4659; 107.371; 91.269; 116.622;  

COD ID: 1549467
CIF file Formula: - C2 H3 Na O2 -
Comments: Birger Dittrich; Justin Bergmann; Peter Roloff; Guido J. Reiss New Polymorphs of the Phase-Change Material Sodium Acetate Crystals 8 (2018) 213
Space group: P c c a
Cell volume: 353.89
Cell parameters: 5.9482; 10.0866; 5.8984; 90; 90; 90;  

COD ID: 1549468
CIF file Formula: - C2 H3 Na O2 -
Comments: Birger Dittrich; Justin Bergmann; Peter Roloff; Guido J. Reiss New Polymorphs of the Phase-Change Material Sodium Acetate Crystals 8 (2018) 213
Space group: P 4/n m m :2
Cell volume: 173.64
Cell parameters: 4.156; 4.156; 10.053; 90; 90; 90;  

COD ID: 1549470
CIF file Formula: - H3 Na O8 Se2 V -
Comments: 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 8 (2018) 215
Space group: C 1 2/c 1
Cell volume: 1644.6
Cell parameters: 18.5779; 7.5662; 12.5844; 90; 111.612; 90;  

COD ID: 1557475
CIF file Formula: - C16 H22 N2 O9 Rh2 -
Comments: Arakawa, 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 10(2) (2020) 85
Space group: P 1 21/c 1
Cell volume: 2005.4
Cell parameters: 8.1042; 14.3559; 17.696; 90; 103.077; 90;  

COD ID: 1558499
CIF file Formula: - Ca7.97 Fe0.56 Mg9.47 O48 P12 -
Comments: 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 10(6) (2020) 464
Space group: C 1 2/c 1
Cell volume: 3822.53
Cell parameters: 22.7973; 9.9833; 17.0522; 90; 99.954; 90;  

COD ID: 1558500
CIF file Formula: - C36 H20 Br3.77 Cl8 Cu2 N4 -
Comments: Finocchio, 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 10(6) (2020) 477
Space group: P -1
Cell volume: 992.76
Cell parameters: 7.8673; 11.0031; 11.7131; 82.325; 89.994; 81.179;  

COD ID: 1558501
CIF file Formula: - C18 H13.5 B Cu F4 N6 O0.75 -
Comments: 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 10(6) (2020) 548
Space group: C 1 c 1
Cell volume: 7807.6
Cell parameters: 19.6546; 17.9133; 24.0581; 90; 112.816; 90;  

COD ID: 1559469
CIF file Formula: - C8 H12 N2 O2 -
Comments: Destro, 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 10(10) (2020) 894
Space group: P b c n
Cell volume: 823.55
Cell parameters: 15.072; 7.9873; 6.841; 90; 90; 90;  

COD ID: 1559470
CIF file Formula: - C8 H16 N2 O4 -
Comments: Destro, 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 10(10) (2020) 894
Space group: P 1 21/c 1
Cell volume: 1013
Cell parameters: 7.959; 7.154; 17.799; 90; 91.68; 90;  

COD ID: 1559471
CIF file Formula: - Bi6 Br7 -
Comments: Stroganova, Ekaterina A.; Troyanov, Sergey I.; Morozov, Igor V.; Kuznetsov, Alexey N. Bismuth Polycations Revisited: Alternative Synthesis and Electronic Structure of Bi6Br7, and Bonding in Main-Group Polyatomic Ions from a Direct Space Perspective Crystals 10(10) (2020) 940
Space group: P n n m
Cell volume: 3306.65
Cell parameters: 15.4996; 23.6435; 9.0231; 90; 90; 90;  

COD ID: 1559472
CIF file Formula: - C19 H16 O6 -
Comments: Shin, 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 10(10) (2020) 911
Space group: P 1 21/c 1
Cell volume: 3135.7
Cell parameters: 12.0654; 11.0666; 23.955; 90; 101.376; 90;  

COD ID: 1560703
CIF file Formula: - C38 H32 Cl2 Ir N8 Pt -
Comments: 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 11(3) (2021) 236
Space group: C 1 2/c 1
Cell volume: 8982.2
Cell parameters: 13.0437; 24.3865; 28.8657; 90; 101.971; 90;  

COD ID: 1563171
CIF file Formula: - C80 H92 Co5 N2 O48 -
Comments: Lu, 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 11(6) (2021) 574
Space group: P -1
Cell volume: 2297.9
Cell parameters: 10.532; 13.2619; 18.1118; 70.883; 74.056; 85.86;  

COD ID: 1563172
CIF file Formula: - C82 H86 Co6 N2 O48 -
Comments: Lu, 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 11(6) (2021) 574
Space group: P -1
Cell volume: 2453.6
Cell parameters: 11.2564; 15.9785; 16.5583; 62.347; 73.527; 70.219;  

COD ID: 1564146
CIF file Formula: - C49.8 H81.1 O15.75 -
Comments: Shubin, Kirill; Bērziņš, Agris; Belyakov, Sergey Crystal Structures of New Ivermectin Pseudopolymorphs Crystals 11(2) (2021) 172
Space group: I 1 2 1
Cell volume: 5299.5
Cell parameters: 14.8197; 9.1753; 39.094; 90; 94.49; 90;  

COD ID: 1564147
CIF file Formula: - C98.1 H151.2 O29 -
Comments: Shubin, Kirill; Bērziņš, Agris; Belyakov, Sergey Crystal Structures of New Ivermectin Pseudopolymorphs Crystals 11(2) (2021) 172
Space group: P 21 21 21
Cell volume: 10100.9
Cell parameters: 16.7127; 24.5777; 24.5908; 90; 90; 90;  

COD ID: 1564148
CIF file Formula: - C98.1 H152.2 O28.5 -
Comments: Shubin, Kirill; Bērziņš, Agris; Belyakov, Sergey Crystal Structures of New Ivermectin Pseudopolymorphs Crystals 11(2) (2021) 172
Space group: P 21 21 21
Cell volume: 10108.5
Cell parameters: 16.7309; 24.5805; 24.5797; 90; 90; 90;  

COD ID: 1566036
CIF file Formula: - Ca3 Cs2 O16 S4 -
Comments: Fang, Penglin; Tang, Wenyue; Shen, Yaoguo; Hong, Jinquan; Li, Yongming; Jia, Junrong Crystal Structure and Theoretical Analysis of Cs2Ca3(SO4)4 Crystals 12(2) (2022) 126
Space group: P 1 21/c 1
Cell volume: 802.04
Cell parameters: 9.9153; 9.376; 9.8044; 90; 118.365; 90;  

COD ID: 1566037
CIF file Formula: - Ca7 Mg O16 Si4 -
Comments: Bao, Xinjian; He, Mingyue; Zhang, Zhigang; Liu, Xi Crystal Structure and Some Thermodynamic Properties of Ca7MgSi4O16-Bredigite Crystals 11(1) (2020) 14
Space group: P n n m
Cell volume: 1344
Cell parameters: 18.3434; 6.7313; 10.8844; 90; 90; 90;  

COD ID: 1566038
CIF file Formula: - C56 H45 Cu F6 N2 O1.5 P3 -
Comments: Arnosti, 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 11(2) (2021) 185
Space group: P -1
Cell volume: 2421.34
Cell parameters: 11.4728; 14.2115; 16.0992; 92.018; 91.054; 112.546;  

COD ID: 1566039
CIF file Formula: - C44 H32 F9 O8 Pr -
Comments: Mautner, 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 11(2) (2021) 179
Space group: P 1 21/c 1
Cell volume: 4042.4
Cell parameters: 8.9307; 28.9448; 16.2421; 90; 105.674; 90;  

COD ID: 1566040
CIF file Formula: - C62 H40 F9 N4 O6 Pr -
Comments: Mautner, 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 11(2) (2021) 179
Space group: P -1
Cell volume: 2632.08
Cell parameters: 11.9059; 15.3694; 16.5675; 79.097; 70.308; 67.575;  

COD ID: 1566041
CIF file Formula: - C54 H36 F9 N2 O8 Pr -
Comments: Mautner, 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 11(2) (2021) 179
Space group: P 1 21/c 1
Cell volume: 4740.7
Cell parameters: 13.2021; 14.6509; 24.8108; 90; 98.938; 90;  

COD ID: 1566042
CIF file Formula: - C54 H36 F9 N2 O6 Pr -
Comments: Mautner, 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 11(2) (2021) 179
Space group: P c a 21
Cell volume: 4711.7
Cell parameters: 20.1848; 11.9034; 19.6102; 90; 90; 90;  

COD ID: 1566043
CIF file Formula: - C28 H20 Cl N O -
Comments: Tan, 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 11(5) (2021) 530
Space group: P -1
Cell volume: 1068.2
Cell parameters: 6.9675; 7.6046; 20.706; 83.02; 80.403; 83.126;  

COD ID: 1566044
CIF file Formula: - C30 H22 Cl7 N O -
Comments: Tan, 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 11(5) (2021) 530
Space group: P -1
Cell volume: 1542.9
Cell parameters: 10.1961; 10.854; 14.091; 84.387; 87.485; 84.125;  

COD ID: 1567430
CIF file Formula: - C8 H13 N O Si -
Comments: 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 12(8) (2022) 1054
Space group: P b c a
Cell volume: 4025.4
Cell parameters: 11.6876; 24.898; 13.833; 90; 90; 90;  

COD ID: 1567431
CIF file Formula: - C8 H13 N S Si -
Comments: 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 12(8) (2022) 1054
Space group: P 1 21/m 1
Cell volume: 523.71
Cell parameters: 6.6079; 7.2078; 11.1025; 90; 97.954; 90;  

COD ID: 1567432
CIF file Formula: - C12 H14 N2 O2 Si -
Comments: 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 12(8) (2022) 1054
Space group: P 1 21/c 1
Cell volume: 2558.8
Cell parameters: 12.7881; 10.7211; 18.6634; 90; 90.247; 90;  

COD ID: 1567433
CIF file Formula: - C12 H14 N2 S2 Si -
Comments: 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 12(8) (2022) 1054
Space group: P -1
Cell volume: 1395.13
Cell parameters: 9.7145; 11.5896; 12.9509; 73.601; 89.903; 85.998;  

COD ID: 1567434
CIF file Formula: - C22 H18 N2 O2 Si -
Comments: 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 12(8) (2022) 1054
Space group: P 1
Cell volume: 1431.76
Cell parameters: 6.1626; 8.8822; 26.4639; 88.692; 88.561; 81.453;  

COD ID: 1567435
CIF file Formula: - C22 H18 N2 S2 Si -
Comments: 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 12(8) (2022) 1054
Space group: P -1
Cell volume: 972.92
Cell parameters: 9.4763; 10.2415; 11.1044; 96.698; 114.442; 90.107;  

COD ID: 1567436
CIF file Formula: - C22 H18 N2 S2 Si -
Comments: 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 12(8) (2022) 1054
Space group: P 1 21/n 1
Cell volume: 1973.33
Cell parameters: 12.3581; 12.704; 12.5693; 90; 90.262; 90;  

COD ID: 1567437
CIF file Formula: - C22 H18 N2 S2 Si -
Comments: 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 12(8) (2022) 1054
Space group: C 1 2/c 1
Cell volume: 2076.33
Cell parameters: 10.9877; 19.5766; 9.7361; 90; 97.501; 90;  

COD ID: 1567438
CIF file Formula: - C29 H26 N2 S2 Si -
Comments: 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 12(8) (2022) 1054
Space group: P -1
Cell volume: 1317.8
Cell parameters: 9.7034; 11.2023; 13.2853; 73.607; 72.232; 82.511;  

COD ID: 1567585
CIF file Formula: - C68 H48 Co N10 S2 -
Comments: 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 12(8) (2022) 1136
Space group: P 1 21/c 1
Cell volume: 2870.06
Cell parameters: 8.7148; 18.4121; 18.2547; 90; 101.524; 90;  

COD ID: 1567586
CIF file Formula: - C54 H50 Cl6 Co N10 S2 -
Comments: 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 12(8) (2022) 1136
Space group: P 1 21/n 1
Cell volume: 2710.13
Cell parameters: 8.3422; 16.5164; 19.9774; 90; 100.072; 90;  

COD ID: 1567587
CIF file Formula: - C73 H59 Cl9 Co N10 O2 S2 -
Comments: 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 12(8) (2022) 1136
Space group: P 1 21/c 1
Cell volume: 3699.3
Cell parameters: 14.7142; 9.842; 25.64; 90; 94.944; 90;  

COD ID: 1567588
CIF file Formula: - C52.8 H48.8 Cl2.4 Co N10 S2 -
Comments: 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 12(8) (2022) 1136
Space group: P 1 21/n 1
Cell volume: 2521.87
Cell parameters: 13.3183; 12.5045; 15.2418; 90; 96.533; 90;  

COD ID: 1567589
CIF file Formula: - C33 H24 N4 -
Comments: 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 12(8) (2022) 1136
Space group: C 1 2/c 1
Cell volume: 4988.3
Cell parameters: 34.855; 8.6116; 30.178; 90; 146.585; 90;  

COD ID: 1567735
CIF file Formula: - C2 H5 N O2 -
Comments: Balashova, Elena; Levin, Aleksandr A.; Davydov, Valery; Smirnov, Alexander; Starukhin, Anatoly; Pavlov, Sergey; Krichevtsov, Boris; Zolotarev, Andrey; Zhang, Hongjun; Li, Fangzhe; Ke, Hua Croconic Acid Doped Glycine Single Crystals: Growth, Crystal Structure, UV-Vis, FTIR, Raman and Photoluminescence Spectroscopy Crystals 12(10) (2022) 1342
Space group: P 31
Cell volume: 231.3
Cell parameters: 6.9848; 6.9848; 5.4744; 90; 90; 120;  

COD ID: 1567736
CIF file Formula: - C2 H5 N O2 -
Comments: Balashova, Elena; Levin, Aleksandr A.; Davydov, Valery; Smirnov, Alexander; Starukhin, Anatoly; Pavlov, Sergey; Krichevtsov, Boris; Zolotarev, Andrey; Zhang, Hongjun; Li, Fangzhe; Ke, Hua Croconic Acid Doped Glycine Single Crystals: Growth, Crystal Structure, UV-Vis, FTIR, Raman and Photoluminescence Spectroscopy Crystals 12(10) (2022) 1342
Space group: P 1 21/n 1
Cell volume: 309.43
Cell parameters: 5.1004; 11.9664; 5.457; 90; 111.714; 90;  

COD ID: 1567904
CIF file Formula: - C12 H40 F18 Fe4 N6 O2 -
Comments: Li, Teng; Lightfoot, Philip Layered Hybrid iron Fluorides Crystals 12(10) (2022) 1443
Space group: P 1 2/c 1
Cell volume: 2811.3
Cell parameters: 16.9178; 13.6023; 12.8848; 90; 108.53; 90;  

COD ID: 1567905
CIF file Formula: - C4 H14 F5 Fe N2 O -
Comments: Li, Teng; Lightfoot, Philip Layered Hybrid iron Fluorides Crystals 12(10) (2022) 1443
Space group: P 1 21/n 1
Cell volume: 917.06
Cell parameters: 11.4695; 5.8774; 13.609; 90; 91.553; 90;  

COD ID: 1567906
CIF file Formula: - C8 H26 F13 Fe3 N4 O -
Comments: Li, Teng; Lightfoot, Philip Layered Hybrid iron Fluorides Crystals 12(10) (2022) 1443
Space group: C 1 2/c 1
Cell volume: 3770.4
Cell parameters: 20.5365; 13.5405; 13.5727; 90; 92.588; 90;  

COD ID: 1568586
CIF file Formula: - In O3 Tb -
Comments: Min, Chang; Wu, You; Li, Yanbin; Zhou, Chunming; Cheong, Sang-Wook; Lu, Xiaosong; Zhou, Tianyuan; Zhang, Le Structural and Improper Ferroelectric Properties of TbInO3 Single Crystal Grown by Laser Floating Zone Crystals 13(2) (2023) 287
Space group: P 63 c m
Cell volume: 424.195
Cell parameters: 6.3088; 6.3088; 12.3067; 90; 90; 120;  

COD ID: 1568587
CIF file Formula: - Cl2 Cu H4 O2 -
Comments: 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 13(2) (2023) 293
Space group: P m n a
Cell volume: 221.333
Cell parameters: 8.0553; 3.7295; 7.3674; 90; 90; 90;  

COD ID: 1568588
CIF file Formula: - Cl2 Cu H4 O2 -
Comments: 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 13(2) (2023) 293
Space group: P m n a
Cell volume: 220.32
Cell parameters: 8.0405; 3.7238; 7.3585; 90; 90; 90;  

COD ID: 1568589
CIF file Formula: - Cl2 H12 Ni O6 -
Comments: 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 13(2) (2023) 293
Space group: I 1 2/m 1
Cell volume: 400.29
Cell parameters: 6.5628; 7.033; 8.7326; 90; 96.723; 90;  

COD ID: 1568590
CIF file Formula: - Cl2 H12 Ni O6 -
Comments: 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 13(2) (2023) 293
Space group: I 1 2/m 1
Cell volume: 399.36
Cell parameters: 6.5579; 7.0244; 8.7291; 90; 96.702; 90;  

COD ID: 1568591
CIF file Formula: - C10 H18 Ca O5 -
Comments: Lopresti, Mattia; Milanesio, Marco; Palin, Luca The Crystal Structure of Calcium Sebacate by X-ray Powder Diffraction Data Crystals 13(2) (2023) 261
Space group: P -1
Cell volume: 622.21
Cell parameters: 5.8633; 6.8363; 16.0587; 79.338; 81.318; 82.834;  

COD ID: 1568592
CIF file Formula: - C6 H5 N O2 -
Comments: Baptista, Diogo S.; Piedade, M. Fátima M.; Esteves, Catarina V. Solubility and Crystallization Studies of Picolinic Acid Crystals 13(3) (2023) 392
Space group: C 1 2/c 1
Cell volume: 1061.29
Cell parameters: 21.211; 3.7625; 13.9555; 90; 107.653; 90;  

COD ID: 1568782
CIF file Formula: - C51 H47 N9 O14 Zn -
Comments: Pook, Niels-Patrick Supramolecular Structure of Tris(1,10-phenanthroline)zinc(II)-Cation and N,N′,N″-tris(carboxymethyl)-1,3,5-benzenetricarboxamide-Anion: Synthesis, Crystal Structure, Vibrational Spectra, and Theoretical Investigations Crystals 13(4) (2023) 569
Space group: P b c a
Cell volume: 9517.1
Cell parameters: 14.6426; 20.0946; 32.345; 90; 90; 90;  

COD ID: 1568783
CIF file Formula: - C22 H28 Cl Cu Ho N6 O10 -
Comments: Zhang, Shaoliang; Du, Ruili; Fan, Xiufang; Zhao, Xinhua; Wang, Yanlan; Li, Shanshan Self-Assembly Heterometallic Cu-Ln Complexes: Synthesis, Crystal Structures and Magnetic Characterization Crystals 13(3) (2023) 535
Space group: P 1 21/n 1
Cell volume: 2864.6
Cell parameters: 8.8038; 16.3659; 19.8889; 90; 91.557; 90;  

COD ID: 1568784
CIF file Formula: - C22 H28 Cl Cu Gd N6 O10 -
Comments: Zhang, Shaoliang; Du, Ruili; Fan, Xiufang; Zhao, Xinhua; Wang, Yanlan; Li, Shanshan Self-Assembly Heterometallic Cu-Ln Complexes: Synthesis, Crystal Structures and Magnetic Characterization Crystals 13(3) (2023) 535
Space group: P 1 21/n 1
Cell volume: 2931
Cell parameters: 8.8191; 16.5598; 20.0787; 90; 91.748; 90;  

COD ID: 1569035
CIF file Formula: - C10 H4 Br4 N2 -
Comments: 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 13(4) (2023) 704
Space group: P -1
Cell volume: 1293.15
Cell parameters: 7.8725; 10.9122; 15.6053; 103.034; 96.915; 92.46;  

COD ID: 1569036
CIF file Formula: - C12 H12 Br4 Co N4 O8 -
Comments: 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 13(4) (2023) 704
Space group: C 1 2/c 1
Cell volume: 2051.8
Cell parameters: 18.3716; 11.4111; 13.2287; 90; 132.282; 90;  

COD ID: 1569037
CIF file Formula: - C15 H22 Br N S3 -
Comments: Caltagirone, 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 13(4) (2023) 616
Space group: P -1
Cell volume: 842.66
Cell parameters: 8.0769; 8.5225; 12.5476; 99.941; 96.608; 93.121;  

COD ID: 1569038
CIF file Formula: - C16 H23 Cl3 N2 O3 S3 -
Comments: Caltagirone, 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 13(4) (2023) 616
Space group: P -1
Cell volume: 1125.9
Cell parameters: 8.5163; 9.5058; 14.5582; 73.29; 89.59; 85.96;  

COD ID: 1569039
CIF file Formula: - C18 H23 Cl N2 O S3 -
Comments: Caltagirone, 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 13(4) (2023) 616
Space group: P -1
Cell volume: 958.31
Cell parameters: 8.4811; 9.8093; 11.8739; 99.469; 99.016; 93.623;  

COD ID: 1569279
CIF file Formula: - C42 H28 -
Comments: Sonina, Alina A.; Cheshkina, Darya S.; Kazantsev, Maxim S. Additive-Assisted Crystallization of 9,10-Diphenylanthracene Crystals 13(6) (2023) 861
Space group: P 1 21/c 1
Cell volume: 1430.43
Cell parameters: 16.4311; 8.03; 11.2057; 90; 104.651; 90;  

COD ID: 1569440
CIF file Formula: - C7 H13 N3 Si -
Comments: Herbig, Marcus; Kroke, Edwin; Wagler, Jörg Molecular Structures and Intermolecular Hydrogen Bonding of Silylated 2-Aminopyrimidines Crystals 13(7) (2023) 990
Space group: P 1 21/c 1
Cell volume: 1943.92
Cell parameters: 9.4337; 19.5412; 10.7349; 90; 100.794; 90;  

COD ID: 1569441
CIF file Formula: - C10 H14 N6 Si -
Comments: Herbig, Marcus; Kroke, Edwin; Wagler, Jörg Molecular Structures and Intermolecular Hydrogen Bonding of Silylated 2-Aminopyrimidines Crystals 13(7) (2023) 990
Space group: P -1
Cell volume: 608.08
Cell parameters: 8.6757; 8.874; 9.0989; 64.211; 75.463; 79.194;  

COD ID: 1569442
CIF file Formula: - C30 H38 N18 O Si2 -
Comments: Herbig, Marcus; Kroke, Edwin; Wagler, Jörg Molecular Structures and Intermolecular Hydrogen Bonding of Silylated 2-Aminopyrimidines Crystals 13(7) (2023) 990
Space group: P -1
Cell volume: 1780.7
Cell parameters: 10.064; 11.1921; 18.6757; 72.898; 89; 63.346;  

COD ID: 1569443
CIF file Formula: - C23 H24 N12 O Si -
Comments: Herbig, Marcus; Kroke, Edwin; Wagler, Jörg Molecular Structures and Intermolecular Hydrogen Bonding of Silylated 2-Aminopyrimidines Crystals 13(7) (2023) 990
Space group: P 1 21/c 1
Cell volume: 7593.81
Cell parameters: 15.9611; 21.1674; 22.6832; 90; 97.74; 90;  

COD ID: 1569444
CIF file Formula: - C22 H19 Cl N4 S -
Comments: Salama, 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 13(7) (2023) 992
Space group: P 1 21/c 1
Cell volume: 1992.94
Cell parameters: 11.0242; 16.5074; 11.0507; 90; 97.688; 90;  

COD ID: 1569445
CIF file Formula: - C23 H17 Cl N4 S -
Comments: Salama, 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 13(7) (2023) 992
Space group: P -1
Cell volume: 1984.17
Cell parameters: 12.1537; 12.8679; 15.0994; 70.272; 69.417; 67.402;  

COD ID: 1569624
CIF file Formula: - C4 H11 Cl2 Cu N5 -
Comments: Pastrana-Dávila, Andrea; Minotta, Gianella; Ellena, Javier; Santiago, Pedro H. O.; D’Vries, Richard F. Synthesis, Characterization and Structural Analysis of Two New Biguanide Complexes Crystals 13(8) (2023) 1176
Space group: P 1 21/n 1
Cell volume: 909.64
Cell parameters: 7.5287; 16.5771; 7.9737; 90; 113.925; 90;  

COD ID: 1569625
CIF file Formula: - C12 H39 Cl5.01 Co2 N15 O3 -
Comments: Pastrana-Dávila, Andrea; Minotta, Gianella; Ellena, Javier; Santiago, Pedro H. O.; D’Vries, Richard F. Synthesis, Characterization and Structural Analysis of Two New Biguanide Complexes Crystals 13(8) (2023) 1176
Space group: P 1 21/n 1
Cell volume: 3032.62
Cell parameters: 10.3808; 26.2761; 11.3407; 90; 101.374; 90;  

COD ID: 1569626
CIF file Formula: - C20 H28 Co O8 Pb -
Comments: Zhang, Yuxuan; Wei, Zheng; Dikarev, Evgeny V. Synthesis, Structure, and Characterizations of a Heterobimetallic Heptanuclear Complex [Pb2Co5(acac)14] Crystals 13(7) (2023) 1089
Space group: P 1 21/c 1
Cell volume: 2424.7
Cell parameters: 8.7792; 20.142; 13.72; 90; 91.957; 90;  

COD ID: 1569627
CIF file Formula: - C70 H98 Co5 O28 Pb2 -
Comments: Zhang, Yuxuan; Wei, Zheng; Dikarev, Evgeny V. Synthesis, Structure, and Characterizations of a Heterobimetallic Heptanuclear Complex [Pb2Co5(acac)14] Crystals 13(7) (2023) 1089
Space group: P 1 21/c 1
Cell volume: 4143.63
Cell parameters: 23.8452; 10.7063; 16.3561; 90; 97.096; 90;  

COD ID: 1569628
CIF file Formula: - C6 H6 Cl N O3 -
Comments: Johnson, Aidan V.; Piedade, M. Fátima M.; Esteves, Catarina V. pH-Dependent Crystallization of 2-, 4-, 5-, and 6-Hydroxynicotinic Acids in Aqueous Media Crystals 13(7) (2023) 1062
Space group: P 1 21/c 1
Cell volume: 1464.8
Cell parameters: 12.648; 13.634; 8.574; 90; 97.801; 90;  

COD ID: 1569629
CIF file Formula: - Al0.28 B4 Bi0.07 Fe2.72 O12 Sm0.93 -
Comments: Smirnova, Ekaterina S.; Alekseeva, Olga A.; Artemov, Vladimir V.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Sidorova, Ekaterina V.; Frolov, Kirill V.; Gudim, Irina A. Crystal Structure of Bismuth-Containing Samarium Iron–Aluminium Borates Sm1−xBixFe3−yAly(BO3)4 (x = 0.05–0.07, y = 0–0.28) in the Temperature Range of 25–500 K Crystals 13(7) (2023) 1128
Space group: R 3 2 :H
Cell volume: 596.428
Cell parameters: 9.5443; 9.5443; 7.5603; 90; 90; 120;  

COD ID: 1569630
CIF file Formula: - Al0.28 B4 Bi0.07 Fe2.72 O12 Sm0.93 -
Comments: Smirnova, Ekaterina S.; Alekseeva, Olga A.; Artemov, Vladimir V.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Sidorova, Ekaterina V.; Frolov, Kirill V.; Gudim, Irina A. Crystal Structure of Bismuth-Containing Samarium Iron–Aluminium Borates Sm1−xBixFe3−yAly(BO3)4 (x = 0.05–0.07, y = 0–0.28) in the Temperature Range of 25–500 K Crystals 13(7) (2023) 1128
Space group: R 3 2 :H
Cell volume: 596.51
Cell parameters: 9.543; 9.543; 7.5634; 90; 90; 120;  

COD ID: 1569631
CIF file Formula: - Al0.25 B4 Bi0.05 Fe2.75 O12 Sm0.95 -
Comments: Smirnova, Ekaterina S.; Alekseeva, Olga A.; Artemov, Vladimir V.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Sidorova, Ekaterina V.; Frolov, Kirill V.; Gudim, Irina A. Crystal Structure of Bismuth-Containing Samarium Iron–Aluminium Borates Sm1−xBixFe3−yAly(BO3)4 (x = 0.05–0.07, y = 0–0.28) in the Temperature Range of 25–500 K Crystals 13(7) (2023) 1128
Space group: R 3 2 :H
Cell volume: 596.525
Cell parameters: 9.5435; 9.5435; 7.5628; 90; 90; 120;  

COD ID: 1569632
CIF file Formula: - Al0.17 B4 Bi0.05 Fe2.83 O12 Sm0.95 -
Comments: Smirnova, Ekaterina S.; Alekseeva, Olga A.; Artemov, Vladimir V.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Sidorova, Ekaterina V.; Frolov, Kirill V.; Gudim, Irina A. Crystal Structure of Bismuth-Containing Samarium Iron–Aluminium Borates Sm1−xBixFe3−yAly(BO3)4 (x = 0.05–0.07, y = 0–0.28) in the Temperature Range of 25–500 K Crystals 13(7) (2023) 1128
Space group: R 3 2 :H
Cell volume: 598.862
Cell parameters: 9.5534; 9.5534; 7.5767; 90; 90; 120;  

COD ID: 1569633
CIF file Formula: - Al0.28 B4 Bi0.07 Fe2.72 O12 Sm0.93 -
Comments: Smirnova, Ekaterina S.; Alekseeva, Olga A.; Artemov, Vladimir V.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Sidorova, Ekaterina V.; Frolov, Kirill V.; Gudim, Irina A. Crystal Structure of Bismuth-Containing Samarium Iron–Aluminium Borates Sm1−xBixFe3−yAly(BO3)4 (x = 0.05–0.07, y = 0–0.28) in the Temperature Range of 25–500 K Crystals 13(7) (2023) 1128
Space group: R 3 2 :H
Cell volume: 594.61
Cell parameters: 9.5329; 9.5329; 7.5553; 90; 90; 120;  

COD ID: 1569634
CIF file Formula: - B4 Bi0.05 Fe3 O12 Sm0.95 -
Comments: Smirnova, Ekaterina S.; Alekseeva, Olga A.; Artemov, Vladimir V.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Sidorova, Ekaterina V.; Frolov, Kirill V.; Gudim, Irina A. Crystal Structure of Bismuth-Containing Samarium Iron–Aluminium Borates Sm1−xBixFe3−yAly(BO3)4 (x = 0.05–0.07, y = 0–0.28) in the Temperature Range of 25–500 K Crystals 13(7) (2023) 1128
Space group: R 3 2 :H
Cell volume: 601.125
Cell parameters: 9.565; 9.565; 7.5869; 90; 90; 120;  

COD ID: 1569635
CIF file Formula: - Al0.28 B4 Bi0.07 Fe2.72 O12 Sm0.93 -
Comments: Smirnova, Ekaterina S.; Alekseeva, Olga A.; Artemov, Vladimir V.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Sidorova, Ekaterina V.; Frolov, Kirill V.; Gudim, Irina A. Crystal Structure of Bismuth-Containing Samarium Iron–Aluminium Borates Sm1−xBixFe3−yAly(BO3)4 (x = 0.05–0.07, y = 0–0.28) in the Temperature Range of 25–500 K Crystals 13(7) (2023) 1128
Space group: R 3 2 :H
Cell volume: 596.388
Cell parameters: 9.5443; 9.5443; 7.5598; 90; 90; 120;  

COD ID: 1569636
CIF file Formula: - Al0.07 B4 Bi0.07 Fe2.93 O12 Sm0.93 -
Comments: Smirnova, Ekaterina S.; Alekseeva, Olga A.; Artemov, Vladimir V.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Sidorova, Ekaterina V.; Frolov, Kirill V.; Gudim, Irina A. Crystal Structure of Bismuth-Containing Samarium Iron–Aluminium Borates Sm1−xBixFe3−yAly(BO3)4 (x = 0.05–0.07, y = 0–0.28) in the Temperature Range of 25–500 K Crystals 13(7) (2023) 1128
Space group: R 3 2 :H
Cell volume: 600.015
Cell parameters: 9.5595; 9.5595; 7.5816; 90; 90; 120;  

COD ID: 1569637
CIF file Formula: - Al0.28 B4 Bi0.07 Fe2.72 O12 Sm0.93 -
Comments: Smirnova, Ekaterina S.; Alekseeva, Olga A.; Artemov, Vladimir V.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Sidorova, Ekaterina V.; Frolov, Kirill V.; Gudim, Irina A. Crystal Structure of Bismuth-Containing Samarium Iron–Aluminium Borates Sm1−xBixFe3−yAly(BO3)4 (x = 0.05–0.07, y = 0–0.28) in the Temperature Range of 25–500 K Crystals 13(7) (2023) 1128
Space group: R 3 2 :H
Cell volume: 596.424
Cell parameters: 9.5444; 9.5444; 7.5601; 90; 90; 120;  

COD ID: 1569638
CIF file Formula: - Al0.28 B4 Bi0.07 Fe2.72 O12 Sm0.93 -
Comments: Smirnova, Ekaterina S.; Alekseeva, Olga A.; Artemov, Vladimir V.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Sidorova, Ekaterina V.; Frolov, Kirill V.; Gudim, Irina A. Crystal Structure of Bismuth-Containing Samarium Iron–Aluminium Borates Sm1−xBixFe3−yAly(BO3)4 (x = 0.05–0.07, y = 0–0.28) in the Temperature Range of 25–500 K Crystals 13(7) (2023) 1128
Space group: R 3 2 :H
Cell volume: 596.543
Cell parameters: 9.5439; 9.5439; 7.5624; 90; 90; 120;  

COD ID: 1569639
CIF file Formula: - Al0.28 B4 Bi0.07 Fe2.72 O12 Sm0.93 -
Comments: Smirnova, Ekaterina S.; Alekseeva, Olga A.; Artemov, Vladimir V.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Sidorova, Ekaterina V.; Frolov, Kirill V.; Gudim, Irina A. Crystal Structure of Bismuth-Containing Samarium Iron–Aluminium Borates Sm1−xBixFe3−yAly(BO3)4 (x = 0.05–0.07, y = 0–0.28) in the Temperature Range of 25–500 K Crystals 13(7) (2023) 1128
Space group: R 3 2 :H
Cell volume: 596.657
Cell parameters: 9.5443; 9.5443; 7.5632; 90; 90; 120;  

COD ID: 1569640
CIF file Formula: - Al0.28 B4 Bi0.07 Fe2.72 O12 Sm0.93 -
Comments: Smirnova, Ekaterina S.; Alekseeva, Olga A.; Artemov, Vladimir V.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Sidorova, Ekaterina V.; Frolov, Kirill V.; Gudim, Irina A. Crystal Structure of Bismuth-Containing Samarium Iron–Aluminium Borates Sm1−xBixFe3−yAly(BO3)4 (x = 0.05–0.07, y = 0–0.28) in the Temperature Range of 25–500 K Crystals 13(7) (2023) 1128
Space group: R 3 2 :H
Cell volume: 597.148
Cell parameters: 9.5452; 9.5452; 7.568; 90; 90; 120;  

COD ID: 1569641
CIF file Formula: - Al0.28 B4 Bi0.07 Fe2.72 O12 Sm0.93 -
Comments: Smirnova, Ekaterina S.; Alekseeva, Olga A.; Artemov, Vladimir V.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Sidorova, Ekaterina V.; Frolov, Kirill V.; Gudim, Irina A. Crystal Structure of Bismuth-Containing Samarium Iron–Aluminium Borates Sm1−xBixFe3−yAly(BO3)4 (x = 0.05–0.07, y = 0–0.28) in the Temperature Range of 25–500 K Crystals 13(7) (2023) 1128
Space group: R 3 2 :H
Cell volume: 596.468
Cell parameters: 9.5438; 9.5438; 7.5616; 90; 90; 120;  

COD ID: 1569642
CIF file Formula: - Al0.28 B4 Bi0.07 Fe2.72 O12 Sm0.93 -
Comments: Smirnova, Ekaterina S.; Alekseeva, Olga A.; Artemov, Vladimir V.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Sidorova, Ekaterina V.; Frolov, Kirill V.; Gudim, Irina A. Crystal Structure of Bismuth-Containing Samarium Iron–Aluminium Borates Sm1−xBixFe3−yAly(BO3)4 (x = 0.05–0.07, y = 0–0.28) in the Temperature Range of 25–500 K Crystals 13(7) (2023) 1128
Space group: R 3 2 :H
Cell volume: 596.545
Cell parameters: 9.5441; 9.5441; 7.5621; 90; 90; 120;  

COD ID: 1569643
CIF file Formula: - Al0.28 B4 Bi0.07 Fe2.72 O12 Sm0.93 -
Comments: Smirnova, Ekaterina S.; Alekseeva, Olga A.; Artemov, Vladimir V.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Sidorova, Ekaterina V.; Frolov, Kirill V.; Gudim, Irina A. Crystal Structure of Bismuth-Containing Samarium Iron–Aluminium Borates Sm1−xBixFe3−yAly(BO3)4 (x = 0.05–0.07, y = 0–0.28) in the Temperature Range of 25–500 K Crystals 13(7) (2023) 1128
Space group: R 3 2 :H
Cell volume: 596.445
Cell parameters: 9.544; 9.544; 7.561; 90; 90; 120;  

COD ID: 1569644
CIF file Formula: - Al0.28 B4 Bi0.07 Fe2.72 O12 Sm0.93 -
Comments: Smirnova, Ekaterina S.; Alekseeva, Olga A.; Artemov, Vladimir V.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Sidorova, Ekaterina V.; Frolov, Kirill V.; Gudim, Irina A. Crystal Structure of Bismuth-Containing Samarium Iron–Aluminium Borates Sm1−xBixFe3−yAly(BO3)4 (x = 0.05–0.07, y = 0–0.28) in the Temperature Range of 25–500 K Crystals 13(7) (2023) 1128
Space group: R 3 2 :H
Cell volume: 596.476
Cell parameters: 9.545; 9.545; 7.5598; 90; 90; 120;  

COD ID: 1569645
CIF file Formula: - Al0.28 B4 Bi0.07 Fe2.72 O12 Sm0.93 -
Comments: Smirnova, Ekaterina S.; Alekseeva, Olga A.; Artemov, Vladimir V.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Sidorova, Ekaterina V.; Frolov, Kirill V.; Gudim, Irina A. Crystal Structure of Bismuth-Containing Samarium Iron–Aluminium Borates Sm1−xBixFe3−yAly(BO3)4 (x = 0.05–0.07, y = 0–0.28) in the Temperature Range of 25–500 K Crystals 13(7) (2023) 1128
Space group: R 3 2 :H
Cell volume: 596.457
Cell parameters: 9.5446; 9.5446; 7.5602; 90; 90; 120;  

COD ID: 1569803
CIF file Formula: - C47 H31 N2 O7 Zn2 -
Comments: Lee, Dong Hee; Park, In-Hyeok Zn(II) Metal–Organic Frameworks with a Long Spacer Ligand and a Tricarboxylate Coligand Crystals 13(8) (2023) 1266
Space group: F d d 2
Cell volume: 22258.7
Cell parameters: 60.5386; 62.2276; 5.9086; 90; 90; 90;  

COD ID: 1569804
CIF file Formula: - C74 H46 N2 O12 Zn3 -
Comments: Lee, Dong Hee; Park, In-Hyeok Zn(II) Metal–Organic Frameworks with a Long Spacer Ligand and a Tricarboxylate Coligand Crystals 13(8) (2023) 1266
Space group: C 1 2/c 1
Cell volume: 9490.1
Cell parameters: 11.4402; 30.8405; 27.0931; 90; 96.884; 90;  

COD ID: 1569805
CIF file Formula: - C296 H184 N8 O48 Zn8 -
Comments: Lee, Dong Hee; Park, In-Hyeok Zn(II) Metal–Organic Frameworks with a Long Spacer Ligand and a Tricarboxylate Coligand Crystals 13(8) (2023) 1266
Space group: P 1 21/c 1
Cell volume: 21346
Cell parameters: 16.3093; 27.4589; 48.052; 90; 97.288; 90;  

COD ID: 1569806
CIF file Formula: - C92 H112 N2 O12 Zn3 -
Comments: Lee, 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 13(8) (2023) 1226
Space group: P -1
Cell volume: 1981.6
Cell parameters: 12.2791; 12.5594; 14.265; 92.774; 115.24; 92.827;  

COD ID: 1569807
CIF file Formula: - C124 H148 Cu3 N6 O14 -
Comments: Lee, 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 13(8) (2023) 1226
Space group: P -1
Cell volume: 2733.2
Cell parameters: 13.2103; 13.8734; 16.6325; 102.709; 111.677; 92.99;  

COD ID: 1569808
CIF file Formula: - C16 H17 Cd N9 O S2 -
Comments: Soliman, 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 13(8) (2023) 1198
Space group: P b c a
Cell volume: 4204.5
Cell parameters: 14.6614; 15.9147; 18.0194; 90; 90; 90;  

COD ID: 1569809
CIF file Formula: - C14 H17 Cd Cl N10 O -
Comments: Soliman, 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 13(8) (2023) 1198
Space group: P -1
Cell volume: 944.1
Cell parameters: 9.323; 10.936; 11.312; 112.637; 104.547; 105.133;  

COD ID: 1569810
CIF file Formula: - C22 H17 Cl2 F6 N3 O3 -
Comments: Li, 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 13(8) (2023) 1241
Space group: P -1
Cell volume: 2400.6
Cell parameters: 9.5129; 15.13; 17.615; 72.469; 83.305; 89.077;  

COD ID: 1569811
CIF file Formula: - C22 H17 Cl2 F6 N3 O3 -
Comments: Li, 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 13(8) (2023) 1241
Space group: P 1 21/c 1
Cell volume: 4555.6
Cell parameters: 9.0555; 39.923; 12.6015; 90; 90.376; 90;  

COD ID: 1569812
CIF file Formula: - C22 H17 Cl2 F6 N3 O3 -
Comments: Li, 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 13(8) (2023) 1241
Space group: P c a 21
Cell volume: 2289.7
Cell parameters: 12.6058; 20.0622; 9.0538; 90; 90; 90;  

COD ID: 1569813
CIF file Formula: - Al8.08 B3.51 Ca0.25 F0.07 H3.36 Li0.76 Mn0.16 Na0.42 Oi31 Si5.49 -
Comments: Rizzo, Floriana; Bosi, Ferdinando; Tempesta, Gioacchino; Agrosì, Giovanna Compositional Variation and Crystal-Chemical Characterization of a Watermelon Variety of Tourmaline from Anjanabonoina, Central Madagascar Crystals 13(8) (2023) 1290
Space group: R 3 m :H
Cell volume: 1541.94
Cell parameters: 15.8313; 15.8313; 7.104; 90; 90; 120;  

COD ID: 1569814
CIF file Formula: - Al8.08 B3.51 Ca0.25 F0.33 H3.36 Li0.76 Mn0.16 Na0.42 O31 Si5.49 -
Comments: Rizzo, Floriana; Bosi, Ferdinando; Tempesta, Gioacchino; Agrosì, Giovanna Compositional Variation and Crystal-Chemical Characterization of a Watermelon Variety of Tourmaline from Anjanabonoina, Central Madagascar Crystals 13(8) (2023) 1290
Space group: R 3 m :H
Cell volume: 1554.82
Cell parameters: 15.8839; 15.8839; 7.116; 90; 90; 120;  

COD ID: 1569815
CIF file Formula: - Al24.24 B10.53 Ca0.74 F0.2 H10.08 Li2.27 Mn0.49 Na1.26 Oi93 Si16.47 -
Comments: Rizzo, Floriana; Bosi, Ferdinando; Tempesta, Gioacchino; Agrosì, Giovanna Compositional Variation and Crystal-Chemical Characterization of a Watermelon Variety of Tourmaline from Anjanabonoina, Central Madagascar Crystals 13(8) (2023) 1290
Space group: R 3 m :H
Cell volume: 1542.54
Cell parameters: 15.8345; 15.8345; 7.1039; 90; 90; 120;  

COD ID: 1569816
CIF file Formula: - Al8.08 B3.51 Ca0.25 F0.07 H3.36 Li0.76 Mn0.16 Na0.42 Oi31 Si5.49 -
Comments: Rizzo, Floriana; Bosi, Ferdinando; Tempesta, Gioacchino; Agrosì, Giovanna Compositional Variation and Crystal-Chemical Characterization of a Watermelon Variety of Tourmaline from Anjanabonoina, Central Madagascar Crystals 13(8) (2023) 1290
Space group: R 3 m :H
Cell volume: 1552.41
Cell parameters: 15.874; 15.874; 7.1138; 90; 90; 120;  

COD ID: 1569817
CIF file Formula: - C7 H14 N8 O4 S -
Comments: Moskalenko, Ivan V.; Shilovskikh, Vladimir V.; Nesterov, Pavel V.; Novikov, Alexander S.; Omarova, Malika; Sadovnichii, Roman V.; Gurzhiy, Vladislav V.; Orekhov, Nikita D.; Skorb, Ekaterina V. Supramolecular Assemblies of Melamine-2-Thiobarbiturate and Melamine-Barbiturate-2-Thiobarbiturate: Experimental and Theoretical Studies Crystals 13(9) (2023) 1302
Space group: P 1 21/c 1
Cell volume: 1295.19
Cell parameters: 10.7987; 17.7255; 6.76698; 90; 90.698; 90;  

COD ID: 1569818
CIF file Formula: - C15 H14 N O3 Sb -
Comments: Knerr, Steven; Böhme, Uwe; Herbig, Marcus Coordinative Unsaturation in an Antimony(III)-Complex with the 2-Salicylidenaminophenolato Ligand: Synthesis, Crystal Structure, Spectroscopic Analysis, and DFT Studies Crystals 13(9) (2023) 1300
Space group: P 1 21/c 1
Cell volume: 1353.35
Cell parameters: 10.8915; 16.5156; 7.7866; 90; 104.932; 90;  

COD ID: 1570054
CIF file Formula: - O25 P6 Pb10 -
Comments: Krivovichev, Sergey V.; Engel, Günther The Crystal Structure of Pb10(PO4)6O Revisited: The Evidence of Superstructure Crystals 13(9) (2023) 1371
Space group: P -3
Cell volume: 1237.06
Cell parameters: 9.8109; 9.8109; 14.8403; 90; 90; 120;  

COD ID: 1570247
CIF file Formula: - C18 H14 N4 O -
Comments: Sarhan, Ahmed A. M.; Haukka, Matti; Barakat, Assem; Soliman, Saied M.; Boraei, Ahmed T. A.; Sopaih, Manar; Salama, Eid E. 4-Methyl/Phenyl-1,2,5,6-tetraazafluoranthen-3(2H)-ones Synthesis: Mechanistic Pathway Study and Single-Crystal X-ray Analysis of the Intermediates Crystals 13(11) (2023) 1537
Space group: P 21 21 21
Cell volume: 1407.63
Cell parameters: 5.0471; 12.5114; 22.2915; 90; 90; 90;  

COD ID: 1570248
CIF file Formula: - C18 H12 N4 O2 -
Comments: Sarhan, Ahmed A. M.; Haukka, Matti; Barakat, Assem; Soliman, Saied M.; Boraei, Ahmed T. A.; Sopaih, Manar; Salama, Eid E. 4-Methyl/Phenyl-1,2,5,6-tetraazafluoranthen-3(2H)-ones Synthesis: Mechanistic Pathway Study and Single-Crystal X-ray Analysis of the Intermediates Crystals 13(11) (2023) 1537
Space group: P 1 21/c 1
Cell volume: 1456.1
Cell parameters: 14.9862; 4.8641; 20.3991; 90; 101.697; 90;  

COD ID: 1570249
CIF file Formula: - C15 H12 N2 O3 -
Comments: Sarhan, Ahmed A. M.; Haukka, Matti; Barakat, Assem; Soliman, Saied M.; Boraei, Ahmed T. A.; Sopaih, Manar; Salama, Eid E. 4-Methyl/Phenyl-1,2,5,6-tetraazafluoranthen-3(2H)-ones Synthesis: Mechanistic Pathway Study and Single-Crystal X-ray Analysis of the Intermediates Crystals 13(11) (2023) 1537
Space group: P 1 21/c 1
Cell volume: 1266.93
Cell parameters: 15.34; 5.0292; 16.7042; 90; 100.545; 90;  

COD ID: 1570250
CIF file Formula: - C20 H14 N2 O3 -
Comments: Sarhan, Ahmed A. M.; Haukka, Matti; Barakat, Assem; Soliman, Saied M.; Boraei, Ahmed T. A.; Sopaih, Manar; Salama, Eid E. 4-Methyl/Phenyl-1,2,5,6-tetraazafluoranthen-3(2H)-ones Synthesis: Mechanistic Pathway Study and Single-Crystal X-ray Analysis of the Intermediates Crystals 13(11) (2023) 1537
Space group: P 1 21/n 1
Cell volume: 1600.77
Cell parameters: 16.89752; 5.76627; 17.97633; 90; 113.947; 90;  

COD ID: 1570517
CIF file Formula: - C28 H32 Fe N12 Ni -
Comments: 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 13(12) (2023) 1658
Space group: P -1
Cell volume: 798.42
Cell parameters: 8.8641; 10.0807; 10.235; 106.771; 105.118; 103.206;  

COD ID: 1570518
CIF file Formula: - C44 H40 Fe N12 Ni -
Comments: 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 13(12) (2023) 1658
Space group: P -1
Cell volume: 1044.6
Cell parameters: 9.4355; 9.9756; 12.5092; 98.322; 93.508; 115.15;  

COD ID: 1570519
CIF file Formula: - C14 H16 Fe N8 Ni -
Comments: 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 13(12) (2023) 1658
Space group: C 1 2/m 1
Cell volume: 868.6
Cell parameters: 16.452; 7.273; 7.423; 90; 102.055; 90;  

COD ID: 1570568
CIF file Formula: - Dy2 O5 Si -
Comments: 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 13(12) (2023) 1687
Space group: I 1 2/a 1
Cell volume: 863.89
Cell parameters: 10.4642; 6.74981; 12.5396; 90; 102.739; 90;  

COD ID: 1570569
CIF file Formula: - Dy2 O5 Si -
Comments: 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 13(12) (2023) 1687
Space group: I 1 2/a 1
Cell volume: 863.37
Cell parameters: 10.4617; 6.74837; 12.5382; 90; 102.748; 90;  

COD ID: 1570570
CIF file Formula: - Er2 O5 Si -
Comments: 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 13(12) (2023) 1687
Space group: I 1 2/a 1
Cell volume: 845.62
Cell parameters: 10.369; 6.7028; 12.464; 90; 102.533; 90;  

COD ID: 1570571
CIF file Formula: - Ho2 O5 Si -
Comments: 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 13(12) (2023) 1687
Space group: I 1 2/a 1
Cell volume: 854.8
Cell parameters: 10.4156; 6.7273; 12.5019; 90; 102.63; 90;  

COD ID: 1570706
CIF file Formula: - Bi6 O15 Te2 -
Comments: Kim, Sun Woo; Chang, Hong Young Structural Analysis, Characterization, and First-Principles Calculations of Bismuth Tellurium Oxides, Bi6Te2O15 Crystals 14(1) (2023) 23
Space group: P n m a
Cell volume: 1293.2
Cell parameters: 10.5831; 22.694; 5.3843; 90; 90; 90;  

COD ID: 1570707
CIF file Formula: - K Na O4 S -
Comments: Shablinskii, 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 14(1) (2023) 27
Space group: P -3 m 1
Cell volume: 206.75
Cell parameters: 5.6914; 5.6914; 7.37; 90; 90; 120;  

COD ID: 1570708
CIF file Formula: - K Na O4 S -
Comments: Shablinskii, 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 14(1) (2023) 27
Space group: P 63/m m c
Cell volume: 215.7
Cell parameters: 5.669; 5.669; 7.75; 90; 90; 120;  

COD ID: 1570709
CIF file Formula: - K Na O4 S -
Comments: Shablinskii, 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 14(1) (2023) 27
Space group: P 63/m m c
Cell volume: 231.25
Cell parameters: 5.654; 5.654; 8.353; 90; 90; 120;  

COD ID: 1570896
CIF file Formula: - C30 H43 Br2 Co N8 O8 -
Comments: Hu, 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 14(1) (2024) 87
Space group: P -1
Cell volume: 924.3
Cell parameters: 8.566; 9.831; 11.508; 75.764; 79.755; 88.092;  

COD ID: 1570897
CIF file Formula: - C30 H43 Br2 Co N8 O8 -
Comments: Hu, 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 14(1) (2024) 87
Space group: P -1
Cell volume: 936.8
Cell parameters: 8.724; 9.687; 11.556; 77.799; 78.954; 88.451;  

COD ID: 1571107
CIF file Formula: - C32 H16 Ga N8 O0.5 -
Comments: Zugenmaier, Peter Crystal and Molecular Structures of Two Phthalocyanines, Chloro(phthalocyaninato)gallium(III) (ClGaPc) and µ-Oxobis(phthalocyaninato)gallium(III) (PcGaOGaPc) Crystals 14(2) (2024) 182
Space group: P -1
Cell volume: 1245.9
Cell parameters: 7.848; 12.529; 12.72; 91.03; 94.94; 89.98;  

COD ID: 1571108
CIF file Formula: - C28 H25 B Cu F4 N6 P -
Comments: Castro, Jesús; Ferraro, Valentina; Bortoluzzi, Marco Single-Crystal X-ray Structure Determination of Tris(pyrazol-1-yl)methane Triphenylphosphine Copper(I) Tetrafluoroborate, Hirshfeld Surface Analysis and DFT Calculations Crystals 14(2) (2024) 162
Space group: P 1 21/c 1
Cell volume: 2837.2
Cell parameters: 11.9442; 15.5313; 15.9059; 90; 105.945; 90;  

COD ID: 1571109
CIF file Formula: - Al F5 Fe H14 O7 -
Comments: 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 14(2) (2024) 197
Space group: C 1 2/m 1
Cell volume: 967.26
Cell parameters: 10.918; 13.802; 6.521; 90; 100.154; 90;  

COD ID: 1571110
CIF file Formula: - Al Co F5 H14 O7 -
Comments: 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 14(2) (2024) 197
Space group: C 1 2/m 1
Cell volume: 956.7
Cell parameters: 10.8749; 13.7822; 6.4894; 90; 100.397; 90;  

COD ID: 1571111
CIF file Formula: - Al F5 H14 Ni O7 -
Comments: 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 14(2) (2024) 197
Space group: C 1 2/m 1
Cell volume: 938.82
Cell parameters: 10.788; 13.6952; 6.4554; 90; 100.151; 90;  

COD ID: 1571112
CIF file Formula: - Al F5 Fe H14 O7 -
Comments: 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 14(2) (2024) 197
Space group: P -1
Cell volume: 476.05
Cell parameters: 6.4864; 8.719; 8.7917; 103.834; 96.364; 95.4;  

COD ID: 1571113
CIF file Formula: - Al Co F5 H14 O7 -
Comments: 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 14(2) (2024) 197
Space group: P -1
Cell volume: 470.08
Cell parameters: 6.4434; 8.6691; 8.8031; 104.019; 96.749; 95.254;  

COD ID: 1571114
CIF file Formula: - Al F5 H14 Ni O7 -
Comments: 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 14(2) (2024) 197
Space group: P -1
Cell volume: 460.96
Cell parameters: 6.4022; 8.5874; 8.7691; 104.255; 96.638; 94.816;  

COD ID: 1571115
CIF file Formula: - C H8 Mg N2 O7 S -
Comments: Nikolova, 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 14(3) (2024) 227
Space group: P -1
Cell volume: 367.38
Cell parameters: 5.214; 7.7014; 10.4275; 68.758; 77.177; 71.498;  

COD ID: 1571116
CIF file Formula: - C H10 Mg N2 O8 S -
Comments: Nikolova, 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 14(3) (2024) 227
Space group: P 1 21 1
Cell volume: 412.44
Cell parameters: 5.2452; 7.708; 10.23; 90; 94.291; 90;  

COD ID: 1571376
CIF file Formula: - C24 H28 Mn N4 O5 -
Comments: Boro, Mridul; Baishya, Trishnajyoti; Frontera, Antonio; Barceló-Oliver, Miquel; Bhattacharyya, Manjit K. Energetic Features of H-Bonded and π-Stacked Assemblies in Pyrazole-Based Coordination Compounds of Mn(II) and Cu(II): Experimental and Theoretical Studies Crystals 14(4) (2024) 318
Space group: P b c n
Cell volume: 2369.9
Cell parameters: 19.2401; 12.1579; 10.1312; 90; 90; 90;  

COD ID: 1571377
CIF file Formula: - C18 H26 Cu N4 O4 -
Comments: Boro, Mridul; Baishya, Trishnajyoti; Frontera, Antonio; Barceló-Oliver, Miquel; Bhattacharyya, Manjit K. Energetic Features of H-Bonded and π-Stacked Assemblies in Pyrazole-Based Coordination Compounds of Mn(II) and Cu(II): Experimental and Theoretical Studies Crystals 14(4) (2024) 318
Space group: P b c n
Cell volume: 1900.96
Cell parameters: 15.6899; 10.7161; 11.3062; 90; 90; 90;  

COD ID: 1571378
CIF file Formula: - C7 H7 F3 N4 O2 -
Comments: Yamba, Zaina; Peoble, Anna; Novikov, Egor; Castañeda, Raúl; Timofeeva, Tatiana Interplay of Isomorphs and Polymorphs of Amidino-Copper(II) Complexes with Different Halides Crystals 14(4) (2024) 319
Space group: P 1 21/m 1
Cell volume: 448.82
Cell parameters: 5.0459; 9.373; 9.5454; 90; 96.187; 90;  

COD ID: 1571379
CIF file Formula: - C5 H6 Cl2 Cu N4 -
Comments: Yamba, Zaina; Peoble, Anna; Novikov, Egor; Castañeda, Raúl; Timofeeva, Tatiana Interplay of Isomorphs and Polymorphs of Amidino-Copper(II) Complexes with Different Halides Crystals 14(4) (2024) 319
Space group: P n m a
Cell volume: 836.3
Cell parameters: 8.71; 6.292; 15.26; 90; 90; 90;  

COD ID: 1571380
CIF file Formula: - C5 H6 Br2 Cu N4 -
Comments: Yamba, Zaina; Peoble, Anna; Novikov, Egor; Castañeda, Raúl; Timofeeva, Tatiana Interplay of Isomorphs and Polymorphs of Amidino-Copper(II) Complexes with Different Halides Crystals 14(4) (2024) 319
Space group: P n m a
Cell volume: 891.6
Cell parameters: 8.924; 6.3937; 15.626; 90; 90; 90;  

COD ID: 1571381
CIF file Formula: - C5 H6 Cl2 Cu N4 -
Comments: Yamba, Zaina; Peoble, Anna; Novikov, Egor; Castañeda, Raúl; Timofeeva, Tatiana Interplay of Isomorphs and Polymorphs of Amidino-Copper(II) Complexes with Different Halides Crystals 14(4) (2024) 319
Space group: P n m a
Cell volume: 812.72
Cell parameters: 8.6664; 6.2964; 14.894; 90; 90; 90;  

COD ID: 1571382
CIF file Formula: - C5 H6 Br2 Cu N4 -
Comments: Yamba, Zaina; Peoble, Anna; Novikov, Egor; Castañeda, Raúl; Timofeeva, Tatiana Interplay of Isomorphs and Polymorphs of Amidino-Copper(II) Complexes with Different Halides Crystals 14(4) (2024) 319
Space group: P n m a
Cell volume: 874.92
Cell parameters: 8.943; 6.4316; 15.2113; 90; 90; 90;  

COD ID: 1571383
CIF file Formula: - C6 H7 Cl2 Cu N3 -
Comments: Yamba, Zaina; Peoble, Anna; Novikov, Egor; Castañeda, Raúl; Timofeeva, Tatiana Interplay of Isomorphs and Polymorphs of Amidino-Copper(II) Complexes with Different Halides Crystals 14(4) (2024) 319
Space group: P 1 21/n 1
Cell volume: 852.86
Cell parameters: 8.3731; 10.9315; 9.5637; 90; 103.022; 90;  


Back to the search form
Your own data is not in the COD? Deposit it, thanks!
Top of the page
All data in the COD and the database itself are dedicated to the public domain and licensed under the CC0 License . Users of the data should acknowledge the original authors of the structural data.