Search results

Formula: - O50 P4 Rb0.87 W14 -
Comments: Giroult, J P; Goreaud, M; Labbe, P; Raveau, B Bronzes with a tunnel structure Rb~x~ P~8~ W~8n~ O~(24n+16)~. III. Rb~x~ P~8~ W~28~ O~100~: A member corresponding to a non-integral n value n=~3.5~ Acta Crystallographica B (24,1968-38,1982) 38 (1982) 2342-2347
Space group: P 1 2/c 1
Cell volume: 929.6
Cell parameters: 15.723; 3.764; 17.118; 90; 113.42; 90;

COD ID: 1001237
CIF file	Formula: - O56 P4 Rb0.8 W16 - Comments: Giroult, J P; Goreaud, M; Labbe, P; Raveau, B Rb~x~ P~8~ W~32~ O~112~: A Tunnel Structure Built up from Re O~3~-Type Blocks and P~2~ O~7~ Groups Acta Crystallographica B (24,1968-38,1982) 36 (1980) 2570-2575 Space group: P 1 2/c 1 Cell volume: 1041.8 Cell parameters: 16.194; 3.7719; 17.095; 90; 93.89; 90;

COD ID: 1001341
CIF file	Formula: - Cu F10 H12 Np2 O6 - Comments: Cousson, A; Abazli, H; Jove, J; Gasperin, M Synthese et etude structurale des composes Co Np~2~ F~10~ (H~2~ O)~8~ et Cu Np~2~ F~10~ (H~2~ O)~6~ Journal of the Less-Common Metals 109 (1985) 155-168 Space group: P 1 2/c 1 Cell volume: 1158.6 Cell parameters: 19.043; 7.128; 8.593; 90; 96.63; 90;

COD ID: 1001449

Formula: - K4 Nb8 O34 P5 -
Comments: Benabbas, A; Borel, M M; Grandin, A; Leclaire, A; Raveau, B The niobium phosphate bronze K~5-x~Nb~8~P~5~O~34~, a new tunnel structure, first member of the series (K~3~Nb~6~P~4~O~26~)~n~ . KNb~2~PO~8~ Journal of Solid State Chemistry 87 (1990) 360-365
Space group: P 1 2/c 1
Cell volume: 1516
Cell parameters: 13.904; 6.453; 20.64; 90; 125.05; 90;

COD ID: 1001507

Formula: - Al0.8 K5 Nb7.2 O34 P5 -
Comments: Leclaire, A.; Guerioune, M.; Borel, M. M.; Grandin, A.; Raveau, B. Insertion of potassium in the α-K~4~Nb~8~P~5~O~34~ structure: the niobium phosphates α-K~5~Nb~8-x~M~x~P~5~O~34~ European Journal of Solid State and Inorganic Chemistry 29 (1992) 473-483
Space group: P 1 2/c 1
Cell volume: 1495.5
Cell parameters: 13.747; 6.446; 20.588; 90; 124.94; 90;

COD ID: 1001751
CIF file	Formula: - Cd O4 W - Comments: Daturi, M; Borel, M M; Leclaire, A; Savary, L; Costentin, G; Lavalley, J C; Raveau, B Crystallographic and catalytic studies of a new solid solution Cd Mox W1-x O4 Journal de Chimie Physique et de Physico-Chimie Biologique 93 (1996) 2043-2053 Space group: P 1 2/c 1 Cell volume: 149.4 Cell parameters: 5.0289; 5.8596; 5.0715; 90; 91.519; 90;

COD ID: 1001845
CIF file	Formula: - K O67 P4 W20 - Comments: Labbe, P; Ouachee, D; Goreaud, M; Raveau, B Bronzes with a Tunnel Structure Kx P4 O8 (W O3)2m: The Tenth Member of the Series - K P8 W40 O136 Journal of Solid State Chemistry 50 (1983) 163-172 Space group: P 1 2/c 1 Cell volume: 1251.9 Cell parameters: 19.58899; 3.7681; 16.96999; 90; 91.864; 90;

COD ID: 1004042
CIF file	Formula: - H K2 N O6 S2 - Comments: Barbier, P; Parent, Y; Mairesse, G Crystal structure of K~3~ N (S O~3~)~2~ H~2~ O (I) and fefinement of the crystal structure of K~2~ N H (S O~3~)~2~ (II) Acta Crystallographica B (24,1968-38,1982) 35 (1979) 1308-1312 Space group: P 1 2/c 1 Cell volume: 669.5 Cell parameters: 12.456; 7.483; 7.185; 90; 91.24; 90;

COD ID: 1004118
CIF file	Formula: - Bi26 Mo6.14 O68 V3.86 - Comments: Vannier, R N; Mairesse, G; Abraham, F; Nowogorocki, G Bi26 Mo10 Od solid solution type in the Bi2 O3 - Mo O3 - V2 O5 ternary diagram Journal of Solid State Chemistry 122 (1996) 394-406 Space group: P 1 2/c 1 Cell volume: 1612.1 Cell parameters: 11.633; 5.795; 24.39; 90; 101.35; 90;

COD ID: 1004131
CIF file	Formula: - Bi26 Mo10 O69 - Comments: Vannier, R N; Mairesse, G; Abraham, F; Nowogorocki, G Bi26 Mo10 Od solid solution type in the Bi2 O3 - Mo O3 - V2 O5 ternary diagram Journal of Solid State Chemistry 122 (1996) 394-406 Space group: P 1 2/c 1 Cell volume: 1644.1 Cell parameters: 11.742; 5.8; 24.76999; 90; 102.94; 90;

COD ID: 1004134
CIF file	Formula: - Bi26.4 Mo9.6 O68.4 - Comments: Vannier, R-N; Abraham, F; Nowogrocki, G; Mairesse, G New structural and electrical data on Bi-Mo mixed oxides with a structure based on (B12 O14)(infinite) columns Journal of Solid State Chemistry 142 (1999) 294-304 Space group: P 1 2/c 1 Cell volume: 1648.3 Cell parameters: 11.7525; 5.8005; 24.8024; 90; 102.867; 90;

COD ID: 1010642
CIF file	Formula: - Mg O4 W - Comments: Broch, E K Untersuchungen ueber Kristallstrukturen des Wloframittypus und des Scheelittypus Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk- Naturvidenskapelig Klasse 1929 (1929) 1-618 Space group: P 1 2/c 1 Cell volume: 130.3 Cell parameters: 4.68; 5.66; 4.92; 90; 89.67; 90;

COD ID: 1100533

Formula: - C44 H96 Fe4 N4 P4 Si4 -
Comments: Riese, Ulrike; Harms, Klaus; Pebler, Jürgen; Dehnicke, Kurt Phosphaniminato-Cluster von Eisen. Die Kristallstrukturen von [FeCl(NPEt~3~)]~4~, [Fe(C=C-SiMe~3~)(NPEt~3~)]~4~ und [Fe~3~Cl~4~{NP(NMe~2~)~3~}~3~] Zeitschrift fuer Anorganische und Allgemeine Chemie 625(5) (1999) 746-754
Space group: P 1 2/c 1
Cell volume: 3226.58
Cell parameters: 10.532; 13.185; 23.378; 90; 96.33; 90;

COD ID: 1501600
CIF file	Formula: - C136 H216 N30 O43 S4 - Comments: Laliberté, Dominic; Maris, Thierry; Sirois, Ariane; Wuest, James D. Molecular Tectonics. Dendritic Construction of Porous Hydrogen-Bonded Networks Organic Letters 5(25) (2003) 4787-4790 Space group: P 1 2/c 1 Cell volume: 7866.5 Cell parameters: 19.758; 10.8646; 36.649; 90; 90.759; 90;

COD ID: 1502057
CIF file	Formula: - C10 H14 B F3 K N O2 S - Comments: Molander, Gary A.; Fleury-Brégeot, Nicolas; Hiebel, Marie-Aude Synthesis and cross-coupling of sulfonamidomethyltrifluoroborates. Organic letters 13(7) (2011) 1694-1697 Space group: P 1 2/c 1 Cell volume: 1369.1 Cell parameters: 9.3516; 17.7586; 8.2539; 90; 92.802; 90;

COD ID: 1502744

Formula: - C20 H14 O -
Comments: Schwerin, Andrew F.; Johnson, Justin C.; Smith, Millicent B.; Sreearunothai, Paiboon; Popović, Duska; Cerný, Jirí; Havlas, Zdenek; Paci, Irina; Akdag, Akin; MacLeod, Matthew K.; Chen, Xudong; David, Donald E.; Ratner, Mark A.; Miller, John R.; Nozik, Arthur J.; Michl, Josef Toward designed singlet fission: electronic states and photophysics of 1,3-diphenylisobenzofuran. The journal of physical chemistry. A 114(3) (2010) 1457-1473
Space group: P 1 2/c 1
Cell volume: 1374.51
Cell parameters: 12.8954; 5.5486; 20.0322; 90; 106.472; 90;

COD ID: 1503090
CIF file	Formula: - C21 H12 N2 O2 - Comments: Saha, Sukdeb; Ghosh, Amrita; Mahato, Prasenjit; Mishra, Sandhya; Mishra, Sanjiv K.; Suresh, E.; Das, Satyabrata; Das, Amitava Specific recognition and sensing of CN- in sodium cyanide solution. Organic letters 12(15) (2010) 3406-3409 Space group: P 1 2/c 1 Cell volume: 1531.7 Cell parameters: 15.444; 7.4809; 14.862; 90; 116.866; 90;

COD ID: 1503889
CIF file	Formula: - C27 H35 B F2 N2 - Comments: Ozdemir, Tugba; Atilgan, Serdar; Kutuk, Ilker; Yildirim, Leyla T.; Tulek, Abdullah; Bayindir, Mehmet; Akkaya, Engin U. Solid-state emissive BODIPY dyes with bulky substituents as spacers. Organic letters 11(10) (2009) 2105-2107 Space group: P 1 2/c 1 Cell volume: 1230.1 Cell parameters: 6.7325; 12.196; 15.301; 90; 101.739; 90;

COD ID: 1503927
CIF file	Formula: - C16 H20 O7 - Comments: Schneider, Tobias F.; Kaschel, Johannes; Dittrich, Birger; Werz, Daniel B. anti-Oligoannelated THF moieties: synthesis via push-pull-substituted cyclopropanes. Organic letters 11(11) (2009) 2317-2320 Space group: P 1 2/c 1 Cell volume: 767.8 Cell parameters: 11.269; 5.309; 12.835; 90; 90.832; 90;

COD ID: 1504623
CIF file	Formula: - C38 H36 F6 S2 - Comments: Wang, Yongfeng; Parkin, Sean R.; Gierschner, Johannes; Watson, Mark D. Highly fluorinated benzobisbenzothiophenes. Organic letters 10(15) (2008) 3307-3310 Space group: P 1 2/c 1 Cell volume: 1624.87 Cell parameters: 15.3542; 4.9003; 21.7359; 90; 96.509; 90;

COD ID: 1504839
CIF file	Formula: - C54 H84 O4 Si4 - Comments: Chung, Mee-Kyung; Lightbody, Owen C.; Stryker, Jeffrey M. Ortho-silylated derivatives of tetrakis(2-hydroxyphenyl)ethene: a sterically isolated structural model for oxo-surface binding domains. Organic letters 10(17) (2008) 3825-3828 Space group: P 1 2/c 1 Cell volume: 2894 Cell parameters: 13.769; 11.3446; 19.385; 90; 107.107; 90;

COD ID: 1504897
CIF file	Formula: - C23 H26 N5 O5 - Comments: Yu, Ming-Ming; Li, Zhan-Xian; Wei, Liu-He; Wei, Dong-Hui; Tang, Ming-Sheng A 1,8-naphthyridine-based fluorescent chemodosimeter for the rapid detection of Zn2+ and Cu2+. Organic letters 10(22) (2008) 5115-5118 Space group: P 1 2/c 1 Cell volume: 2497.4 Cell parameters: 7.9753; 16.4471; 19.293; 90; 99.295; 90;

COD ID: 1504935
CIF file	Formula: - C48 H36 Cl6 O6 - Comments: Wadumethrige, Shriya H.; Rathore, Rajendra A facile synthesis of elusive alkoxy-substituted hexa-peri-hexabenzocoronene. Organic letters 10(22) (2008) 5139-5142 Space group: P 1 2/c 1 Cell volume: 8616.3 Cell parameters: 35.377; 10.0059; 25.216; 90; 105.136; 90;

COD ID: 1505744

Formula: - Ba0.5 Bi6 Mo2.5 O17 -
Comments: Muktha, B.; Aarthi, T.; Madras, Giridhar; Guru Row, T. N. Substitution effect on the photocatalytic degradation by the series AxBi26-xMo10O68+0.5y (A = Ba, y = 0; A = Bi, La, y = 2): a kinetic study. The journal of physical chemistry. B 110(21) (2006) 10280-10286
Space group: P 1 2/c 1
Cell volume: 1643.84
Cell parameters: 11.6887; 5.8139; 24.7151; 90; 101.838; 90;

COD ID: 1505782

Formula: - C40 H24.4 Cl7.6 O6 -
Comments: Ben-Haida, Abderrazak; Colquhoun, Howard M.; Hodge, Philip; Williams, David J. Synthesis of a Catechol-Based Poly(ether ether ketone) (“o-PEEK”) by Classical Step-Growth Polymerization and by Entropically Driven Ring-Opening Polymerization of Macrocyclic Oligomers Macromolecules 39(19) (2006) 6467
Space group: P 1 2/c 1
Cell volume: 3766.3
Cell parameters: 35.831; 6.1603; 17.0632; 90; 90.397; 90;

COD ID: 1506124
CIF file	Formula: - C27.5 H28 Cl4 I N3 O4 - Comments: Rege, Pankaj D.; Tian, Yuan; Corey, E. J. Studies of new indole alkaloid coupling methods for the synthesis of haplophytine. Organic letters 8(14) (2006) 3117-3120 Space group: P 1 2/c 1 Cell volume: 3839 Cell parameters: 20.041; 9.284; 21.351; 90; 104.917; 90;

COD ID: 1506867

Formula: - C26 H32 Br2 -
Comments: Heeney, Martin; Bailey, Clare; Giles, Mark; Shkunov, Maxim; Sparrowe, David; Tierney, Steve; Zhang, Weimin; McCulloch, Iain Alkylidene Fluorene Liquid Crystalline Semiconducting Polymers for Organic Field Effect Transistor Devices Macromolecules 37(14) (2004) 5250
Space group: P 1 2/c 1
Cell volume: 2329.89
Cell parameters: 22.4112; 4.59; 24.6403; 90; 113.19; 90;

COD ID: 1507562

Formula: - C28 H24 N2 O4 S12 -
Comments: Zhu, Qin-Yu; Han, Qiong-Hua; Shao, Ming-Yan; Gu, Jing; Shi, Zheng; Dai, Jie Supramolecular and redox chemistry of tetrathiafulvalene monocarboxylic Acid with hydrogen-bonded pyridine and bipyridine molecules. The journal of physical chemistry. B 116(14) (2012) 4239-4247
Space group: P 1 2/c 1
Cell volume: 3547.6
Cell parameters: 22.44; 5.2005; 31.963; 90; 107.996; 90;

COD ID: 1507765
CIF file	Formula: - C6 H20 Al2 F10 N4 - Comments: Adil, K; Le Bail, A; Dujardin, G; Maisonneuve, V A new 1D hybrid fluoroaluminate templated by an original tetramine Polyhedron 26 (2007) 2493-2497 Space group: P 1 2/c 1 Cell volume: 650.67 Cell parameters: 8.528; 7.3938; 13.2368; 90; 128.777; 90;

COD ID: 1507814
CIF file	Formula: - C18 H16 O5 - Comments: Trosien, Simon; Waldvogel, Siegfried R. Synthesis of highly functionalized 9,10-phenanthrenequinones by oxidative coupling using MoCl5. Organic letters 14(12) (2012) 2976-2979 Space group: P 1 2/c 1 Cell volume: 2860.4 Cell parameters: 24.3452; 8.79; 13.733; 90; 103.263; 90;

COD ID: 1507897

Formula: - C64 H82 Cl3 Gd N8 Ni2 O37 -
Comments: Wang, D; Niu, C J; Li, X Z; Zhu, L N; Hao, P P Syntheses, crystal structures and properties of lanthanide complexes featuring infinite molecular rectangle strands constructed from a new macrocyclic metalloligand Inorganica Chimica Acta 391 (2012) 20-27
Space group: P 1 2/c 1
Cell volume: 3799
Cell parameters: 11.582; 13.466; 24.641; 90; 98.69; 90;

COD ID: 1507898

Formula: - C64 H82 Cl3 N8 Ni2 O37 Sm -
Comments: Wang, D; Niu, C J; Li, X Z; Zhu, L N; Hao, P P Syntheses, crystal structures and properties of lanthanide complexes featuring infinite molecular rectangle strands constructed from a new macrocyclic metalloligand Inorganica Chimica Acta 391 (2012) 20-27
Space group: P 1 2/c 1
Cell volume: 3807.3
Cell parameters: 11.587; 13.463; 24.707; 90; 98.95; 90;

COD ID: 1507899

Formula: - C64 H82 Cl3 N8 Ni2 O37 Pr -
Comments: Wang, D; Niu, C J; Li, X Z; Zhu, L N; Hao, P P Syntheses, crystal structures and properties of lanthanide complexes featuring infinite molecular rectangle strands constructed from a new macrocyclic metalloligand Inorganica Chimica Acta 391 (2012) 20-27
Space group: P 1 2/c 1
Cell volume: 3817.9
Cell parameters: 11.569; 13.459; 24.824; 90; 98.98; 90;

COD ID: 1508196
CIF file	Formula: - C57 H90 Ge O3 - Comments: Li, Liangchun; Fukawa, Tomohide; Matsuo, Tsukasa; Hashizume, Daisuke; Fueno, Hiroyuki; Tanaka, Kazuyoshi; Tamao, Kohei A stable germanone as the first isolated heavy ketone with a terminal oxygen atom. Nature chemistry 4(5) (2012) 361-365 Space group: P 1 2/c 1 Cell volume: 2505.3 Cell parameters: 10.0743; 9.9792; 24.924; 90; 90.988; 90;

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: 1508609

Formula: - C37 H44 Ag F3 N4 O3 S -
Comments: Habata, Yoichi; Ikeda, Mari; Yamada, Sachiko; Takahashi, Hiroki; Ueno, Sumiko; Suzuki, Takatoshi; Kuwahara, Shunsuke Argentivorous molecules: structural evidence for Ag(+)-π interactions in solution. Organic letters 14(17) (2012) 4576-4579
Space group: P 1 2/c 1
Cell volume: 1725.8
Cell parameters: 13.471; 9.2889; 19.222; 90; 134.152; 90;

COD ID: 1508770
CIF file	Formula: - C22 H22 F6 N2 - Comments: Müller, Christian H; Fröhlich, Roland; Daniliuc, Constantin G.; Hennecke, Ulrich Efficient Synthesis of Chiral 2,2'-Bipyrrolidines by an anti-Selective Alkene Diamination. Organic letters 14(23) (2012) 5944-5947 Space group: P 1 2/c 1 Cell volume: 1987.89 Cell parameters: 14.5477; 9.8838; 14.5179; 90; 107.769; 90;

COD ID: 1508866
CIF file	Formula: - C12 H18 F6 N2 O2 - Comments: Riofski, Mark V.; Hart, Allison D.; Colby, David A. Amidinate salt of hexafluoroacetone hydrate for the preparation of fluorinated compounds by the release of trifluoroacetate. Organic letters 15(1) (2013) 208-211 Space group: P 1 2/c 1 Cell volume: 1485.81 Cell parameters: 9.4219; 8.6467; 18.7345; 90; 103.222; 90;

COD ID: 1509207
CIF file	Formula: - Ag Au Te4 - Comments: Pertlik, F. Kristallchemie natuerlicher Telluride. I: Verfeinerung der Kristallstruktur des Sylvanits, Au Ag Te4 TMPM. Tschermaks Mineralogische und Petrographische Mitteilungen (1979-) 33 (1984) 203-212 Space group: P 1 2/c 1 Cell volume: 333.144 Cell parameters: 8.95; 4.478; 14.62; 90; 145.35; 90;

COD ID: 1509398
CIF file	Formula: - Ag In O8 W2 - Comments: Okunera, A.S.; Pakhomov, V.I.; Sorokina, O.V.; Fedorov, P.M. Structure and elastic properties of Ag In (W O4)2 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 3 (1977) 765-767 Space group: P 1 2/c 1 Cell volume: 310.704 Cell parameters: 10.44; 5.87; 5.07; 90; 90; 90;

COD ID: 1509505
CIF file	Formula: - Ag P2 S6 V - Comments: Ouvrard, G.; Colombet, P.; Brec, R.; Lee, S. A new chain compound of vanadium (III): Ag1/2 V1/2 P S3 structure, metal ordering, and magnetic properties Materials Research Bulletin 21 (1986) 917-928 Space group: P 1 2/c 1 Cell volume: 409.469 Cell parameters: 6.755; 10.684; 5.921; 90; 106.62; 90;

COD ID: 1510139
CIF file	Formula: - Au F4 Li - Comments: Engelmann, U.; Mueller, B.G. Darstellung und Struktur der Tetrafluoroaurate(III) M(I)(AuF4) mit M(I) = Li, Rb Zeitschrift fuer Anorganische und Allgemeine Chemie 598 (1991) 103-110 Space group: P 1 2/c 1 Cell volume: 308.839 Cell parameters: 4.8532; 6.3429; 10.0443; 90; 92.759; 90;

COD ID: 1510210
CIF file	Formula: - Au K3 Se13 - Comments: Park, Y.; Kanatzidis, M.G. Niedrigdimensionale Polychalcogenid-Verbindungen: Die ungewoehnlichen Strukturen von (AuSe5)n(n-) und (AuSe13)n(3n-) Angewandte Chemie (German Edition) 102 (1990) 945-946 Space group: P 1 2/c 1 Cell volume: 994.334 Cell parameters: 14.949; 4.858; 13.723; 90; 93.86; 90;

COD ID: 1510423
CIF file	Formula: - Au2 I K6 Na O8 - Comments: Hoppe, R.; Schneider, J. Das erste quinquinaere Oxoaurat(I) K6 Na (I O6) (Au O)2 = K6 (Na I O6) (Au O2/2)2 Zeitschrift fuer Anorganische und Allgemeine Chemie 574 (1989) 54-64 Space group: P 1 2/c 1 Cell volume: 696.209 Cell parameters: 7.074; 9.773; 11.994; 90; 122.9; 90;

COD ID: 1510922
CIF file	Formula: - B3 K O9 Zn4 - Comments: Cheng, W.-D.; Kan, Z.-G.; Zhang, H.; Gong, Y.-J; Zhang, Y.-J.; Chen, D.-G.; Wu, D.-S. Synthesis, band structures and optical properties of Zn3 B2 O6 and K Zn4 B3 O9 Solid State Sciences 7 (2005) 179-188 Space group: P 1 2/c 1 Cell volume: 431.661 Cell parameters: 6.8822; 4.9945; 12.5748; 90; 92.954; 90;

COD ID: 1511692
CIF file	Formula: - B8 F12 - Comments: Pardoe, J.A.J.; Parsons, S.; Mackie, I.; Norman, N.C.; Pulham, C.R.; Rankin, D.W.H.; Timms, P.L. The surprising structures of B8 F12 and B10 F12 Angew. Chem. Int. ed. 42 (2003) 571-573 Space group: P 1 2/c 1 Cell volume: 4401.06 Cell parameters: 24.577; 7.334; 25.493; 90; 106.708; 90;

COD ID: 1514322
CIF file	Formula: - C6 H8 Co O4 - Comments: Saines, Paul J.; Barton, Phillip T.; Jura, Marek; Knight, Kevin S.; Cheetham, Anthony K. Cobalt adipate, Co(C6H8O4): antiferromagnetic structure, unusual thermal expansion and magnetoelastic coupling Materials Horizons 1(3) (2014) 332 Space group: P 1 2/c 1 Cell volume: 715.77 Cell parameters: 16.1473; 4.7928; 9.2488; 90; 90.212; 90;

COD ID: 1514418
CIF file	Formula: - C65 H5 N O5 - Comments: Yu, Yuming; Shi, Lijun; Yang, Dazhi; Gan, Liangbing Molecular containers with a dynamic orifice: open-cage fullerenes capable of encapsulating either H2O or H2 under mild conditions Chemical Science 4(2) (2013) 814 Space group: P 1 2/c 1 Cell volume: 4256.6 Cell parameters: 18.742; 13.442; 18.553; 90; 114.4; 90;

COD ID: 1514420
CIF file	Formula: - C68 H9 N O7 - Comments: Yu, Yuming; Shi, Lijun; Yang, Dazhi; Gan, Liangbing Molecular containers with a dynamic orifice: open-cage fullerenes capable of encapsulating either H2O or H2 under mild conditions Chemical Science 4(2) (2013) 814 Space group: P 1 2/c 1 Cell volume: 4363 Cell parameters: 19.163; 13.468; 18.553; 90; 114.32; 90;

COD ID: 1514852

Formula: - C70 H126 Lu4 N16 Na4 O43 -
Comments: Allain, Clémence; Beer, Paul D.; Faulkner, Stephen; Jones, Michael W.; Kenwright, Alan M.; Kilah, Nathan L.; Knighton, Richard C.; Sørensen, Thomas Just; Tropiano, Manuel Lanthanide appended rotaxanes respond to changing chloride concentration Chemical Science 4(1) (2013) 489
Space group: P 1 2/c 1
Cell volume: 4667.84
Cell parameters: 18.0616; 14.969; 18.2262; 90; 108.69; 90;

COD ID: 1514969
CIF file	Formula: - C56 H48 Ag2 F12 N12 O4 P2 - Comments: Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science 3(2) (2012) 359 Space group: P 1 2/c 1 Cell volume: 3085 Cell parameters: 14.883; 11.843; 19.893; 90; 118.38; 90;

COD ID: 1515111
CIF file	Formula: - C23 H29 Br2 Cl3 N2 - Comments: Wiggins, Kelly M.; Moerdyk, Jonathan P.; Bielawski, Christopher W. Homonuclear bond activation using a stable N,N′-diamidocarbene Chemical Science 3(10) (2012) 2986 Space group: P 1 2/c 1 Cell volume: 2660.7 Cell parameters: 18.893; 8.2648; 17.927; 90; 108.099; 90;

COD ID: 1516473

Formula: - C20 H14 O -
Comments: Ryerson, Joseph L.; Schrauben, Joel N.; Ferguson, Andrew J.; Sahoo, Subash Chandra; Naumov, Panče; Havlas, Zdenĕk; Michl, Josef; Nozik, Arthur J.; Johnson, Justin C. Two Thin Film Polymorphs of the Singlet Fission Compound 1,3-Diphenylisobenzofuran The Journal of Physical Chemistry C 118(23) (2014) 12121
Space group: P 1 2/c 1
Cell volume: 1414.3
Cell parameters: 12.998; 5.59; 20.271; 90; 106.215; 90;

COD ID: 1516658

Formula: - C53 H33 Cl3 N6 O2 -
Comments: Leung, Man-kit; Yang, Chih-Chiang; Lee, Jiun-Haw; Tsai, Hsin-Hung; Lin, Chi-Feng; Huang, Chih-Yen; Su, Yuhlong Oliver; Chiu, Chi-Feng The unusual electrochemical and photophysical behavior of 2,2'-bis(1,3,4-oxadiazol-2-yl)biphenyls, effective electron transport hosts for phosphorescent organic light emitting diodes. Organic letters 9(2) (2007) 235-238
Space group: P 1 2/c 1
Cell volume: 2141.76
Cell parameters: 11.0052; 13.4251; 14.8416; 90; 102.384; 90;

COD ID: 1517088
CIF file	Formula: - C20 Cl10 N6 - Comments: Zheng, Shijun; Thompson, Joe D.; Tontcheva, Ana; Khan, Saeed I.; Rubin, Yves Perchloro-2,5,8-triazaphenalenyl radical. Organic letters 7(9) (2005) 1861-1863 Space group: P 1 2/c 1 Cell volume: 1107 Cell parameters: 8.7677; 4.8934; 25.862; 90; 93.889; 90;

COD ID: 1517124

Formula: - C15 H16 Br2 Cl2 O4 V -
Comments: Iva Klepalova; Jan Honzicek; Jaromir Vinklarek; Zdenka Padelkova; Lucie Sebestova; Martina Rezacova Vanadocene and niobocene dihalides containing electron-withdrawing substituents in the cyclopentadienyl rings: Synthesis, characterization and cytotoxicity Inorganica Chimica Acta 402 (2013) 109-115
Space group: P 1 2/c 1
Cell volume: 889.27
Cell parameters: 10.841; 6.875; 12.0651; 90; 98.538; 90;

COD ID: 1517131

Formula: - C60 H58 Co N14 O8 -
Comments: Guang-Feng Hou; Bo Wen; Ying-Hui Yu; Jin-Sheng Gao; Xiao-Dan Wang; Peng-Fei Yan Two novel 2-fold interpenetration frameworks constructed by 4,4'-bis(1H-imidazol-1-yl-methyl)biphenyl cobalt(II) coordination polymer and the effect of dicarboxylic acid Inorganica Chimica Acta 402 (2013) 128-132
Space group: P 1 2/c 1
Cell volume: 2878.5
Cell parameters: 15.6; 9.6539; 20.651; 90; 112.25; 90;

COD ID: 1517598
CIF file	Formula: - C16 H16 Mn N2 O10 - Comments: Shi-Yao Yang; Hong-Bo Yuan; Xiao-Bin Xu; Rong-Bin Huang Influential factors on assembly of first-row transition metal coordination polymers Inorganica Chimica Acta 403 (2013) 53-62 Space group: P 1 2/c 1 Cell volume: 799.13 Cell parameters: 6.9972; 10.0161; 13.8929; 90; 124.842; 90;

COD ID: 1518174
CIF file	Formula: - Ca F5 Mn - Comments: Wandner, K.-H.; Hoppe, R. Zum Jahn-Teller-effekt bei Mn(III)-fluoriden: CaMnF5 Revue de Chimie Minerale 23 (1986) 520-531 Space group: P 1 2/c 1 Cell volume: 399.83 Cell parameters: 8.938; 6.369; 7.83; 90; 116.23; 90;

COD ID: 1518198
CIF file	Formula: - K5 Nb6 O34 P5 Zr2 - Comments: Deniard-Courant, Sylvie; Piffard, Yves; Tournoux, Michel Structure cristalline de K5Nb6Zr2P5O34 Revue de Chimie Minerale 24 (1987) 276-287 Space group: P 1 2/c 1 Cell volume: 1544.5 Cell parameters: 13.991; 6.494; 20.814; 90; 125.24; 90;

COD ID: 1518372
CIF file	Formula: - C69 H35 Mg4 N7 O30 - Comments: Mallick, Arijit; Garai, Bikash; Addicoat, Matthew A.; Petkov, Petko St.; Heine, Thomas; Banerjee, Rahul Solid state organic amine detection in a photochromic porous metal organic framework Chem. Sci. 6(2) (2015) 1420 Space group: P 1 2/c 1 Cell volume: 6082.6 Cell parameters: 34.3413; 10.0447; 17.7382; 90; 96.234; 90;

COD ID: 1519315

Formula: - C54 H60 N4 O6 -
Comments: Lhotak, P. L.; Stibor, I.; Hursthouse, Michael B.; Light, Mark E.; Prokes, I.; Tucker, J. H. R.; Dudic, M.; Miyaji, H. 5,17-bis((6-methyl-2-pyridyl)amido)-25,26,27,28-tetrakis(propoxy)calix(4)arene Crystal Structure Report Archive (2001) 67
Space group: P 1 2/c 1
Cell volume: 9844.2
Cell parameters: 24.7998; 16.6806; 24.9057; 90; 107.161; 90;

COD ID: 1520200
CIF file	Formula: - Mn O4 W - Comments: Ruiz-Fuertes, J.; Friedrich, A.; Gomis, O.; Errandonea, D.; Morgenroth, W.; Sans, J. A.; Santamaría-Pérez, D. High-pressure structural phase transition in MnWO4 Physical Review B 91 (2015) 104109 Space group: P 1 2/c 1 Cell volume: 136.22 Cell parameters: 4.7983; 5.708; 4.9747; 90; 91.124; 90;

COD ID: 1520201
CIF file	Formula: - Mn O4 W - Comments: Ruiz-Fuertes, J.; Friedrich, A.; Gomis, O.; Errandonea, D.; Morgenroth, W.; Sans, J. A.; Santamaría-Pérez, D. High-pressure structural phase transition in MnWO4 Physical Review B 91 (2015) 104109 Space group: P 1 2/c 1 Cell volume: 126.75 Cell parameters: 4.6888; 5.536; 4.8844; 90; 91.415; 90;

COD ID: 1520202
CIF file	Formula: - Mn O4 W - Comments: Ruiz-Fuertes, J.; Friedrich, A.; Gomis, O.; Errandonea, D.; Morgenroth, W.; Sans, J. A.; Santamaría-Pérez, D. High-pressure structural phase transition in MnWO4 Physical Review B 91 (2015) 104109 Space group: P 1 2/c 1 Cell volume: 123.94 Cell parameters: 4.6644; 5.468; 4.8614; 90; 91.603; 90;

COD ID: 1520641
CIF file	Formula: - O4 W Zn - Comments: Dahlborg, Magnus Asberg; Svensson, Goran Structural Changes in the System Zn(1-x)Cd(x)WO4, Determined from Single Crystal Data. Acta Chemica Scandinavica 53 (1999) 1103-1109 Space group: P 1 2/c 1 Cell volume: 132.89 Cell parameters: 4.6986; 5.7293; 4.9367; 90; 90.615; 90;

COD ID: 1520642
CIF file	Formula: - Cd0.11 O4 W Zn0.89 - Comments: Dahlborg, Magnus Asberg; Svensson, Goran Structural Changes in the System Zn(1-x)Cd(x)WO4, Determined from Single Crystal Data. Acta Chemica Scandinavica 53 (1999) 1103-1109 Space group: P 1 2/c 1 Cell volume: 135.85 Cell parameters: 4.7472; 5.767; 4.9629; 90; 90.862; 90;

COD ID: 1520643
CIF file	Formula: - Cd0.6 O4 W Zn0.4 - Comments: Dahlborg, Magnus Asberg; Svensson, Goran Structural Changes in the System Zn(1-x)Cd(x)WO4, Determined from Single Crystal Data. Acta Chemica Scandinavica 53 (1999) 1103-1109 Space group: P 1 2/c 1 Cell volume: 144.53 Cell parameters: 4.9192; 5.843; 5.0301; 90; 91.505; 90;

COD ID: 1520644
CIF file	Formula: - Cd0.884 O4 W Zn0.116 - Comments: Dahlborg, Magnus Asberg; Svensson, Goran Structural Changes in the System Zn(1-x)Cd(x)WO4, Determined from Single Crystal Data. Acta Chemica Scandinavica 53 (1999) 1103-1109 Space group: P 1 2/c 1 Cell volume: 148.59 Cell parameters: 5.0053; 5.8615; 5.0664; 90; 91.467; 90;

COD ID: 1520645
CIF file	Formula: - Cd O4 W - Comments: Dahlborg, Magnus Asberg; Svensson, Goran Structural Changes in the System Zn(1-x)Cd(x)WO4, Determined from Single Crystal Data. Acta Chemica Scandinavica 53 (1999) 1103-1109 Space group: P 1 2/c 1 Cell volume: 150.36 Cell parameters: 5.04; 5.8701; 5.0841; 90; 91.476; 90;

COD ID: 1521117
CIF file	Formula: - Ca5 Cu6 O12 - Comments: Galez, P.; Lomello-Tafin, M.; Opagiste, C.; Bertrand, C.; Hopfinger, T. Crystal structure of Ca4.78 Cu6 O11.60 Journal of Solid State Chemistry 151 (2000) 170-180 Space group: P 1 2/c 1 Cell volume: 1125.44 Cell parameters: 10.9459; 6.3197; 16.839; 90; 104.943; 90;

COD ID: 1521118
CIF file	Formula: - Ca4.78 Cu6 O11.6 - Comments: Galez, P.; Lomello-Tafin, M.; Hopfinger, T.; Opagiste, C.; Bertrand, C. Crystal structure of Ca4.78 Cu6 O11.60 Journal of Solid State Chemistry 151 (2000) 170-180 Space group: P 1 2/c 1 Cell volume: 1125.4 Cell parameters: 10.9456; 6.3192; 16.84079; 90; 104.952; 90;

COD ID: 1521289
CIF file	Formula: - C76 H134 Au B Cl10 F4 P4 Ru2 - Comments: Reinholdt, Anders; Vibenholt, Johan E.; Morsing, Thorbjørn J.; Schau-Magnussen, Magnus; Reeler, Nini E. A.; Bendix, Jesper Carbide complexes as π-acceptor ligands Chem. Sci. 6(10) (2015) 5815 Space group: P 1 2/c 1 Cell volume: 8887 Cell parameters: 19.988; 16.619; 27.233; 90; 100.779; 90;

COD ID: 1524890
CIF file	Formula: - Ba K2 O12 S12 - Comments: Maroy, K. Refinement of the crystal structure of potassium barium hexathionate Acta Chemica Scandinavica (1-27,1973-42,1988) 27 (1973) 1684-1694 Space group: P 1 2/c 1 Cell volume: 1065.4 Cell parameters: 11.591; 10.835; 9.145; 90; 111.93; 90;

COD ID: 1525239
CIF file	Formula: - Bi Na3 O4 - Comments: Schwedes, B.; Hoppe, R. Zur Kenntnis von Na3 Bi O4 und Na3 Sb O4 Zeitschrift fuer Anorganische und Allgemeine Chemie 393 (1972) 136-148 Space group: P 1 2/c 1 Cell volume: 209.316 Cell parameters: 5.871; 6.696; 5.659; 90; 109.8; 90;

COD ID: 1525240
CIF file	Formula: - Na3 O4 Sb - Comments: Schwedes, B.; Hoppe, R. Zur Kenntnis von Na3 Bi O4 und Na3 Sb O4 Zeitschrift fuer Anorganische und Allgemeine Chemie 393 (1972) 136-148 Space group: P 1 2/c 1 Cell volume: 195.309 Cell parameters: 5.795; 6.595; 5.418; 90; 109.4; 90;

COD ID: 1526154

Formula: - Bi4.86 La1.14 O9 -
Comments: Obbade, S.; Drache, M.; Suard, E.; Conflant, P. Ab initio determination of Bi4.86 La1.14 O9 monoclinic structure from powder neutron diffraction data. Characterization of the related solid solution Journal of Solid State Chemistry 162 (2001) 10-19
Space group: P 1 2/c 1
Cell volume: 257.067
Cell parameters: 9.4956; 3.9742; 7.0425; 90; 104.7; 90;

COD ID: 1526733
CIF file	Formula: - F6 Gd2 Nd2 O3 - Comments: Takashima, M.; Nakajima, Y.; Tanioka, T.; Yonezawa, S.; Leblanc, M. Oxide ion conductive structure and chemical stability of Nd2 Gd2 O3 F6 Solid State Sciences 2 (2000) 71-76 Space group: P 1 2/c 1 Cell volume: 177.253 Cell parameters: 3.973; 11.228; 5.595; 90; 134.75; 90;

COD ID: 1527303
CIF file	Formula: - Hg2 O4 S - Comments: Dorm, E. The crystal structure of mercury(I) sulfate and selenate Acta Chemica Scandinavica (1-27,1973-42,1988) 23 (1969) 1607-1615 Space group: P 1 2/c 1 Cell volume: 232.529 Cell parameters: 6.2802; 4.4273; 8.367; 90; 91.76; 90;

COD ID: 1527304
CIF file	Formula: - Hg2 O4 Se - Comments: Dorm, E. The crystal structure of mercury(I) sulfate and selenate Acta Chemica Scandinavica (1-27,1973-42,1988) 23 (1969) 1607-1615 Space group: P 1 2/c 1 Cell volume: 247.545 Cell parameters: 6.3507; 4.587; 8.499; 90; 90.98; 90;

COD ID: 1527647
CIF file	Formula: - In Na O8 W2 - Comments: Klevtsov, P.V.; Klevtsova, R.F. Single-crystal synthesis and investigation of the double tungstates Na R (W O4)2, where R(III)= Fe, Sc Ga and In Journal of Solid State Chemistry 2 (1970) 278-282 Space group: P 1 2/c 1 Cell volume: 294.581 Cell parameters: 10.08; 5.81; 5.03; 90; 90; 90;

COD ID: 1528188
CIF file	Formula: - S5.1 Se2.9 - Comments: Weiss, J. Roentgenographische Untersuchungen an Mischkristallen der Zusammensetzung Sen S8-n Zeitschrift fuer Anorganische und Allgemeine Chemie 435 (1977) 113-118 Space group: P 1 2/c 1 Cell volume: 888.619 Cell parameters: 8.578; 13.386; 9.368; 90; 124.3; 90;

COD ID: 1528189
CIF file	Formula: - S4.7 Se3.3 - Comments: Weiss, J. Roentgenographische Untersuchungen an Mischkristallen der Zusammensetzung Sen S8-n Zeitschrift fuer Anorganische und Allgemeine Chemie 435 (1977) 113-118 Space group: P 1 2/c 1 Cell volume: 890.764 Cell parameters: 8.579; 13.405; 9.354; 90; 124.1; 90;

COD ID: 1529223
CIF file HKL data	Formula: - C4 H3 K N2 O2 S - Comments: N.N. Golovnev; M.S. Molokeev; M.Yu. Belash Crystal structure of potassium 2-thiobarbiturate Journal of Structural Chemistry 54(3) (2013) 566 Space group: P 1 2/c 1 Cell volume: 627.2 Cell parameters: 11.2317; 3.8687; 14.557; 90; 97.448; 90;

COD ID: 1529354
CIF file	Formula: - C14 H22 O2 Se - Comments: Prasad, Poonam Rajesh; Singh, Harkesh B.; Butcher, Ray J. Synthesis, Structure and Antioxidant Activity of Cyclohexene-Fused Selenuranes and Related Derivatives. Molecules (Basel, Switzerland) 20(7) (2015) 12670-12685 Space group: P 1 2/c 1 Cell volume: 1417.4 Cell parameters: 8.7358; 9.1761; 19.689; 90; 116.096; 90;

COD ID: 1529384

Formula: - C H N8 O2 -
Comments: A.M. Astakhov; A.D. Vasiliev; M.S. Molokeev; A.M. Sirotinin; L.A. Kruglyakova; R.S. Stepanov Crystal and Molecular Structure of Nitramino Derivatives of Tetrazole and 1,2,4-Triazole. II. 5-Nitraminotetrazole Diammonium Salt Journal of Structural Chemistry 45(1) (2004) 175-180
Space group: P 1 2/c 1
Cell volume: 654.33
Cell parameters: 7.272; 8.643; 10.427; 90; 93.2; 90;

COD ID: 1529950
CIF file	Formula: - Mo8 O23 - Comments: Fujishita, H.; Sato, M.; Hoshino, S.; Sato, S. Structure determination of low-dimensional conductor Mo8 O23 Journal of Solid State Chemistry 66 (1987) 40-46 Space group: P 1 2/c 1 Cell volume: 881.013 Cell parameters: 13.384; 4.0616; 16.883; 90; 106.27; 90;

COD ID: 1530021
CIF file	Formula: - Br2 Nb4 Se16 - Comments: Grenouilleau, P.; Guemas, L.; Meerschaut, A.; Rouxel, J. M4 Se16 Br2 (M= Nb, Ta), a new chain-like structure from progressive condensation of (M2 Se4) groups Journal of Solid State Chemistry 66 (1987) 293-303 Space group: P 1 2/c 1 Cell volume: 2261.21 Cell parameters: 12.862; 13.862; 16.029; 90; 127.7; 90;

COD ID: 1530022
CIF file	Formula: - Br2 Se16 Ta4 - Comments: Grenouilleau, P.; Meerschaut, A.; Guemas, L.; Rouxel, J. M4 Se16 Br2 (M= Nb, Ta), a new chain-like structure from progressive condensation of (M2 Se4) groups Journal of Solid State Chemistry 66 (1987) 293-303 Space group: P 1 2/c 1 Cell volume: 2262.56 Cell parameters: 12.844; 13.875; 16.018; 90; 127.57; 90;

COD ID: 1530138
CIF file	Formula: - H O4 P Pb - Comments: Katrusiak, A.; Nelmes, R.J. Pressure dependence of the crystal structure of lead hydrogen phosphate (Pb H P O4) Journal of Physics: Condensed Matter 1 (1989) 10165-10174 Space group: P 1 2/c 1 Cell volume: 171.059 Cell parameters: 4.6227; 6.5142; 5.7186; 90; 96.616; 90;

COD ID: 1530642
CIF file	Formula: - H O4 P Pb - Comments: Restori, R.; Tun, Z.; McIntyre, G.J.; Nelmes, R.J. On the pressure dependence of the crystal structure of Pb H P O4 Journal of Physics C 20 (1987) 591-597 Space group: P 1 2/c 1 Cell volume: 172.55 Cell parameters: 4.637; 6.537; 5.731; 90; 96.65; 90;

COD ID: 1530707
CIF file	Formula: - Mo8.8 O29 W1.2 - Comments: Sato, M.; Onoda, M.; Matsuda, Y. Structural transitions in Mon O3n-1 (n=9 and 10) Journal of Physics C 20 (1987) 4763-4771 Space group: P 1 2/c 1 Cell volume: 2183.66 Cell parameters: 17.437; 8.029; 16.787; 90; 111.7; 90;

COD ID: 1530890
CIF file	Formula: - Cs Lu O8 W2 - Comments: Torardi, C.C.; Page, C.; Brixner, L.H.; Blasse, G.; Dirksen, G.J. Structure and luminescence of some Cs Ln W2 O8 compounds Journal of Solid State Chemistry 69 (1987) 171-178 Space group: P 1 2/c 1 Cell volume: 346.438 Cell parameters: 9.322; 5.132; 7.277; 90; 95.66; 90;

COD ID: 1531375
CIF file	Formula: - Mn0.666 O4 Ta1.334 - Comments: Esmaeilzadeh, S.; Grins, J. Meta-stable phases in the Mn - Ta - O system Solid State Sciences 4 (2002) 117-123 Space group: P 1 2/c 1 Cell volume: 139.926 Cell parameters: 4.7565; 5.7281; 5.1358; 90; 90.355; 90;

COD ID: 1532179
CIF file	Formula: - Eu2 F6 La2 O3 - Comments: Takashima, M.; Yonezawa, S.; Leblanc, M. Synthesis and oxide ion conductivity of lanthanum-europium oxide fluoride, La2 Eu2 O3 F6 Solid State Ionics 154 (2002) 547-553 Space group: P 1 2/c 1 Cell volume: 185.17 Cell parameters: 4.03; 11.4; 5.72; 90; 135.2; 90;

COD ID: 1532260

Formula: - O12 Pb2 V5 -
Comments: Shpanchenko, R.V.; Chernaya, V.V.; Abakumov, A.M.; Hadermann, J.; Antipov, E.V.; van Tendeloo, G.; Kaul, E.E.; Geibel, C.; Sheptyakov, D.; Balagurov, A.M. Crystal structure and magnetic properties of the novel oxide Pb2 V5 O12 Zeitschrift fuer Anorganische und Allgemeine Chemie 627 (2001) 2143-2150
Space group: P 1 2/c 1
Cell volume: 498.235
Cell parameters: 8.408; 5.017; 11.94; 90; 98.42; 90;

COD ID: 1532465
CIF file	Formula: - C47.5 H62.5 F6 N1.5 O6.5 P - Comments: Jia, Fei; He, Zhenfeng; Yang, Liu-Pan; Pan, Zhi-Sheng; Yi, Min; Jiang, Ren-Wang; Jiang, Wei Oxatub[4]arene: a smart macrocyclic receptor with multiple interconvertible cavities Chem. Sci. 6(12) (2015) 6731 Space group: P 1 2/c 1 Cell volume: 5002.8 Cell parameters: 15.9874; 18.0758; 18.1871; 90; 107.85; 90;

COD ID: 1532677
CIF file	Formula: - S7 Se - Comments: Laitinen, R.; Niinisto, L.; Steudel, R. Structural studies on the sulfur-selenium binary system Acta Chemica Scandinavica, Series A: (28,1974-) 33 (1979) 737-747 Space group: P 1 2/c 1 Cell volume: 852.427 Cell parameters: 8.498; 13.134; 9.311; 90; 124.89; 90;

COD ID: 1532681
CIF file	Formula: - S6 Se2 - Comments: Laitinen, R.; Niinisto, L.; Steudel, R. Structural studies on the sulfur-selenium binary system Acta Chemica Scandinavica, Series A: (28,1974-) 33 (1979) 737-747 Space group: P 1 2/c 1 Cell volume: 892.177 Cell parameters: 8.596; 13.374; 9.392; 90; 124.28; 90;

COD ID: 1532800
CIF file	Formula: - Fe3 O4 - Comments: Wright, J.P.; Radaelli, P.G.; Attfield, J.P. Charge ordered structure of magnetite Fe3 O4 below the Verwey transition Physical Review, Serie 3. B - Condensed Matter (18,1978-) 66 (2002) 214422-1-214422-15 Space group: P 1 2/c 1 Cell volume: 590.796 Cell parameters: 5.944407; 5.924701; 16.77515; 90; 90.2363; 90;

COD ID: 1534302
CIF file	Formula: - S6.9 Se1.1 - Comments: Boudreau, R.A.; Haendler, H.M. The isostructural gamma-sulfur phase of selenium-sulfur, Sen S8-n Journal of Solid State Chemistry 36 (1981) 289-296 Space group: P 1 2/c 1 Cell volume: 843.988 Cell parameters: 8.34; 13.11; 9.3; 90; 123.9; 90;

COD ID: 1534303
CIF file	Formula: - S4.35 Se3.55 - Comments: Boudreau, R.A.; Haendler, H.M. The isostructural gamma-sulfur phase of selenium-sulfur, Sen S8-n Journal of Solid State Chemistry 36 (1981) 289-296 Space group: P 1 2/c 1 Cell volume: 860.114 Cell parameters: 8.4; 13.26; 9.37; 90; 124.5; 90;

COD ID: 1535411
CIF file	Formula: - Na4 O9 P2 Ti - Comments: Bolotina, N.B.; Maksimov, B.A.; Petricek, V.; Simonov, V.I. Crystal structure of modulated monoclinic Na4 Ti P2 O9 phase at 293K Kristallografiya 40 (1995) 611-625 Space group: P 1 2/c 1 Cell volume: 2060.03 Cell parameters: 13.331; 7.541; 35.245; 90; 144.45; 90;

COD ID: 1535502
CIF file	Formula: - Cs10 O9 Si7 - Comments: Hoffmann, S.; Faessler, T.F.; Hoch, C.; Roehr, C. Alkali metal tetrelide-tetrelates: "double salts" with (E4)(4-) Zintl anions (E = Si, Ge) and the first dimeric cyclotrisilicate ions (Si6 O17)(10-) Angew. Chem. Int. ed. 40 (2001) 4398-4400 Space group: P 1 2/c 1 Cell volume: 2873.03 Cell parameters: 14.877; 8.193; 23.616; 90; 93.53; 90;

COD ID: 1536069
CIF file	Formula: - C H6 Cs2 O6 - Comments: Cirpus, V.; Wittrock, J.; Adam, A. Carbonat-Hydrate der schweren Alkalimetalle: Darstellung und Struktur von Rb2 C O3 * 1.5(H2 O) und Cs2 C O3 * 3(H2 O) Zeitschrift fuer Anorganische und Allgemeine Chemie 627 (2001) 533-538 Space group: P 1 2/c 1 Cell volume: 393.926 Cell parameters: 6.545; 6.7906; 8.864; 90; 90.708; 90;

COD ID: 1536426
CIF file	Formula: - Ge4 Lu6 O17 - Comments: Palkina, K.K.; Dzhurinskii, B.F.; Kuz'mina, N.E.; Lysanova, G.V.; Komova, M.G. Structure and synthesis of lutetium germanate Lu6Ge4O17 Zhurnal Neorganicheskoi Khimii 39 (1994) 184-187 Space group: P 1 2/c 1 Cell volume: 727.152 Cell parameters: 10.878; 6.853; 10.499; 90; 111.71; 90;

COD ID: 1536526
CIF file	Formula: - Cl2 H10 N O8 Pr - Comments: Wickleder, M.S.; Mueller, I.; Meyer, G. Das Chloridnitrat Pr Cl2 (N O3) . 5(H2 O) mit kationischen und anionischen Komplexen gemaess (Pr Cl2 (H2 O)6) (Pr Cl2 (N O3)2 (H2 O)4) Zeitschrift fuer Anorganische und Allgemeine Chemie 627 (2001) 4-6 Space group: P 1 2/c 1 Cell volume: 1008.05 Cell parameters: 12.288; 6.4835; 12.66; 90; 91.91; 90;

COD ID: 1536776
CIF file	Formula: - S7 Te - Comments: Pupp, M.; Weiss, J. Mischkristalle der Zusammensetzung Ten S8-n Zeitschrift fuer Anorganische und Allgemeine Chemie 440 (1978) 31-36 Space group: P 1 2/c 1 Cell volume: 884.365 Cell parameters: 8.578; 13.386; 9.368; 90; 124.7; 90;

COD ID: 1537110

Formula: - Cs48 O21 Sn20 -
Comments: Frisch, G.; Hoch, C.; Roehr, C.; Zoennchen, P.; Becker, K.D.; Niemeier, D. Alkaline metal stannide-stannates: "double salts" with Zintl (Sn4)(4-) and stannate (Sn O3)(4-) anions Zeitschrift fuer Anorganische und Allgemeine Chemie 629 (2003) 1661-1672
Space group: P 1 2/c 1
Cell volume: 6668.69
Cell parameters: 17.018; 8.7744; 45.569; 90; 101.466; 90;

COD ID: 1537539

Formula: - C8 H12 N2 O13 Sn2 -
Comments: Kokunov, Yu.V.; Gorbunova, Yu.E.; Detkov, D.G. Tin(II) oxalate and oxalatofluoride polymeric compounds. Synthesis and crystal structure of (H3 N (C H2)2 N H3)0.5 (Sn F (C2 O4)) * (H2 O) and (H3 N (C H2)2 N H3) (Sn2 (C2 O4)3) * 0.5(H2 O) Zhurnal Neorganicheskoi Khimii 49 (2004) 1094-1100
Space group: P 1 2/c 1
Cell volume: 829.991
Cell parameters: 10.161; 6.141; 14.165; 90; 110.11; 90;

COD ID: 1537550
CIF file	Formula: - Cl4 Zr - Comments: Krebs, B. Die Kristallstruktur von Zirkoniumtetrachlorid Zeitschrift fuer Anorganische und Allgemeine Chemie 378 (1970) 263-272 Space group: P 1 2/c 1 Cell volume: 278.192 Cell parameters: 6.361; 7.407; 6.256; 90; 109.3; 90;

COD ID: 1537569

Formula: - S5.43 Se2.57 -
Comments: Laitinen, R.; Rautenberg, N.; Steidel, J.; Steudel, R. Crystal structure and vibrational analysis of cyclo-triselenium pentasulfide prepared by the reaction of titanocene pentasulfide with dichlorodiselane Zeitschrift fuer Anorganische und Allgemeine Chemie 486 (1982) 116-128
Space group: P 1 2/c 1
Cell volume: 881.019
Cell parameters: 8.55; 13.34; 9.336; 90; 124.17; 90;

COD ID: 1539964
CIF file	Formula: - H O4 P Pb - Comments: Worzala, H.; Jost, K.H. On the mechanism of the conversion of lead dihydrogenphosphate, Pb (H2 P O4)2, into lead monohydrogenphosphate, Pb H P O4, and phosphoric acid Zeitschrift fuer Anorganische und Allgemeine Chemie 486 (1982) 165-176 Space group: P 1 2/c 1 Cell volume: 178.443 Cell parameters: 4.684; 6.642; 5.781; 90; 97.18; 90;

COD ID: 1540106
CIF file	Formula: - F5 O2 Sb3 - Comments: Holz, K.; Mattes, R. Verbindungen des Antimon(III) mit SbFnOm-Koordinationssphaere. Kristallstrukturen von K(SbF2)HAsO4, NH4(SbF2)HAsO4 und Sb3O2F5 Zeitschrift fuer Anorganische und Allgemeine Chemie 578 (1989) 133-142 Space group: P 1 2/c 1 Cell volume: 670.217 Cell parameters: 13.155; 5.927; 9.023; 90; 107.7; 90;

COD ID: 1540427

Formula: - C78 H96 Cl16 Fe2 N8 O18 -
Comments: Sil, Debangsu; Dey, Soumyajit; Kumar, Amit; Bhowmik, Susovan; Rath, Sankar Prasad Oxidation triggers extensive conjugation and unusual stabilization of two di-heme dication diradical intermediates: role of bridging group for electronic communication Chem. Sci. 7(2) (2016) 1212
Space group: P 1 2/c 1
Cell volume: 9281
Cell parameters: 31.467; 9.589; 30.77; 90; 91.556; 90;

COD ID: 1540763
CIF file	Formula: - Cl7 Cs Ti2 - Comments: Zhang, J.; Corbett, J.D. Synthesis and Structure of the Novel Layered Phase CsTi2Cl7 Zeitschrift fuer Anorganische und Allgemeine Chemie 580 (1990) 36-44 Space group: P 1 2/c 1 Cell volume: 523.141 Cell parameters: 7.0076; 6.2256; 12; 90; 92.175; 90;

COD ID: 1541187
CIF file	Formula: - Mo8 O23 - Comments: Magneli, A. The crystal structures of Mo9 O26 (beta'-molybdenum oxide) and Mo8 O23 (beta - molybdenum oxide) Acta Chemica Scandinavica (1-27,1973-42,1988) 2 (1948) 501-517 Space group: P 1 2/c 1 Cell volume: 873.814 Cell parameters: 13.4; 4.04; 16.8; 90; 106.1; 90;

COD ID: 1541666
CIF file	Formula: - C3 H14 Cl Cu N6 O S3 - Comments: Bombicz, P.; Mutikainen, I.; Krunks, M.; Leskela, T.; Madarasz, J.; Niinisto, L. Synthesis, vibrational spectra and X-ray structures of copper(I) thiourea complexes Inorganica Chimica Acta 357 (2004) 513-525 Space group: P 1 2/c 1 Cell volume: 1342.22 Cell parameters: 11.641; 8.179; 14.253; 90; 98.48; 90;

COD ID: 1541873
CIF file	Formula: - F0.5 H0.5 Mn0.5 Na2 O8.5 Si2 Ti0.75 Zr0.75 - Comments: Simonov, V.I.; Belov, N.V. The determination of the structure of seidozerite Kristallografiya 4 (1959) 163-175 Space group: P 1 2/c 1 Cell volume: 700.879 Cell parameters: 5.53; 7.1; 18.3; 90; 102.72; 90;

COD ID: 1541982
CIF file	Formula: - Ba K2 O12 S12 - Comments: Foss, O.; Johnson, K. The crystal structure of potassium barium hexathionate Acta Chemica Scandinavica (1-27,1973-42,1988) 19 (1965) 2207-2218 Space group: P 1 2/c 1 Cell volume: 1060.83 Cell parameters: 11.58; 10.81; 9.14; 90; 112; 90;

COD ID: 1542088
CIF file	Formula: - B6 Ca H12 Mg O17 - Comments: Rumanova, I.M.; Ashirov, A. Determination of the crystal structure of hydroboracite Ca Mg (B3 O4 (O H)3)2 (H2 O)3 Kristallografiya 8 (1963) 828-845 Space group: P 1 2/c 1 Cell volume: 626.745 Cell parameters: 11.71; 6.69; 8.2; 90; 102.67; 90;

COD ID: 1542943

Formula: - C23 H17 F4 N O -
Comments: Wu, Xin-Xing; Chen, Wen-Long; Shen, Yi; Chen, Si; Xu, Peng-Fei; Liang, Yong-Min Palladium-Catalyzed Domino Heck/Intermolecular C-H Bond Functionalization: Efficient Synthesis of Alkylated Polyfluoroarene Derivatives. Organic letters 18(8) (2016) 1784-1787
Space group: P 1 2/c 1
Cell volume: 1922.41
Cell parameters: 13.0334; 8.6509; 17.4221; 90; 101.862; 90;

COD ID: 1543584
CIF file	Formula: - C15 H10 Cd O6 - Comments: Lan Qin; Lei Yu; Xiao-Zhi Yan; Wen-Na Zhao; Lei Han Two sinusoidal wavelike 2D coordination polymers with benzophenone-4,4'-dicarboxylate Inorganica Chimica Acta 409B (2014) 233-237 Space group: P 1 2/c 1 Cell volume: 660.8 Cell parameters: 14.848; 6.391; 7.149; 90; 103.09; 90;

COD ID: 1543585
CIF file	Formula: - C15 H10 O6 Zn - Comments: Lan Qin; Lei Yu; Xiao-Zhi Yan; Wen-Na Zhao; Lei Han Two sinusoidal wavelike 2D coordination polymers with benzophenone-4,4'-dicarboxylate Inorganica Chimica Acta 409B (2014) 233-237 Space group: P 1 2/c 1 Cell volume: 646.7 Cell parameters: 14.539; 6.3406; 7.2354; 90; 104.19; 90;

COD ID: 1544058

Formula: - C54 H40 Cd3 Cl2 N10 O16 -
Comments: Apurba Bhunia; Ennio Zangrando; Soumen Mistri; Subal Chandra Manna Oxalato-bridged oligonuclear complexes of cadmium(II)/lead(II) with bipyridine coligands: Synthesis, crystal structure, electronic spectra, density functional theory calculation and effect of organic compounds on the fluorescence property Inorganica Chimica Acta 409B (2014) 528-537
Space group: P 1 2/c 1
Cell volume: 3037.4
Cell parameters: 14.3047; 9.6601; 22.0345; 90; 94.006; 90;

COD ID: 1544135
CIF file	Formula: - C26 H20 F10 N4 Zn - Comments: Li, Xiao-Qing; Wang, Bin; Ji, He-Yuan; Li, Yue-Sheng Insights into the mechanism for ring-opening polymerization of lactide catalyzed by Zn(C6F5)2/organic superbase Lewis pairs Catal. Sci. Technol. 6(21) (2016) 7763 Space group: P 1 2/c 1 Cell volume: 1379.9 Cell parameters: 12.2298; 7.6667; 17.9898; 90; 125.106; 90;

COD ID: 1544293
CIF file HKL data	Formula: - C10 H11 Cl N2 O4 - Comments: Posel, Maciej; Stoeckli-Evans, Helen 2,4-Dimethylpyrido[1,2-<i>a</i>]pyrimidin-5-ium perchlorate IUCrData 1(10) (2016) x161543 Space group: P 1 2/c 1 Cell volume: 1179.7 Cell parameters: 12.5178; 7.8321; 12.6354; 90; 107.763; 90;

COD ID: 1544632
CIF file	Formula: - C160 H192 B20 F16 Fe8 N56 O48 Pd2 - Comments: Jansze, Suzanne M.; Wise, Matthew D.; Vologzhanina, Anna V.; Scopelliti, Rosario; Severin, Kay PdII2L4-type coordination cages up to three nanometers in size Chem. Sci. 8(3) (2017) 1901 Space group: P 1 2/c 1 Cell volume: 31115.2 Cell parameters: 41.2884; 14.0841; 54.0058; 90; 97.789; 90;

COD ID: 1545316

Formula: - C14 H14 N2 O3 S2 -
Comments: Zhou, Min; Ma, Hang-Ying; Liu, Zhi-Hua; Yang, Guang-Yu; Du, Gang; Ye, Yan-Qing; Li, Gan-Peng; Hu, Qiu-Fen (+)-Meyeniins A-C, Novel Hexahydroimidazo[1,5-c]thiazole Derivatives from the Tubers of Lepidium meyenii: Complete Structural Elucidation by Biomimetic Synthesis and Racemic Crystallization. Journal of agricultural and food chemistry (2017)
Space group: P 1 2/c 1
Cell volume: 1404.5
Cell parameters: 13.0549; 6.8643; 15.8088; 90; 97.519; 90;

COD ID: 1545491

Formula: - C6 H8 Cl2 N2 Pd -
Comments: Konno, Yosuke; Matsushita, Nobuyuki Dichlorido(o-phenylenediamine)palladium(II) IUCrData 2(2) (2017) x170144
Space group: P 1 2/c 1
Cell volume: 440.83
Cell parameters: 7.0734; 10.4076; 6.7019; 90; 116.683; 90;

COD ID: 1546089

Formula: - C52.5 H47 B Cl F2 N3 O8 -
Comments: Sheng, Wanle; Zheng, Yu-Qing; Wu, Qinghua; Wu, Yayang; Yu, Changjiang; Jiao, Lijuan; Hao, Erhong; Wang, Jie-Yu; Pei, Jian Synthesis, Properties, and Semiconducting Characteristics of BF2 Complexes of β,β-Bisphenanthrene-Fused Azadipyrromethenes. Organic letters 19(11) (2017) 2893-2896
Space group: P 1 2/c 1
Cell volume: 2392
Cell parameters: 12.926; 11.204; 19.694; 90; 123; 90;

COD ID: 1546140
CIF file	Formula: - C36 H34 B10 Cl2 F10 Ir N4 P - Comments: Yan, Hong; Li, Xiang; Yin, Yongheng; Lu, Changsheng; Tong, Xiao; Zhao, Qiang Using highly emissive and environmentally sensitive o-carborane-functionalized metallophosphors to monitor mitochondrial polarity Chem. Sci. (2017) Space group: P 1 2/c 1 Cell volume: 4903.3 Cell parameters: 17.3958; 12.1322; 24.263; 90; 106.755; 90;

COD ID: 1546741

Formula: - C28 H38 F6 N6 O4 P Ru -
Comments: Li, Cai; Ip, Kwok-Wa; Man, Wai-Lun; Song, Dan; He, Ming-Liang; Yiu, Shek-Man; Lau, Tai-Chu; ZHU, Guangyu Cytotoxic (Salen)ruthenium(III) Anticancer Complexes Exhibit Different Modes of Cell Death Directed by Axial Ligands Chem. Sci. (2017)
Space group: P 1 2/c 1
Cell volume: 1577.89
Cell parameters: 9.2078; 10.49143; 16.4278; 90; 96.1345; 90;

COD ID: 1546845

Formula: - C28 H22 N4 Ni3 O16 -
Comments: Liu, Feng; Gao, Wei; Zhang, Xiu-Mei; Liu, Jie-Ping; Gao, En-Qing Four coordination polymers based on dinuclear and trinuclear units with a new multifunctional pyridyl-dicarboxylate ligand: luminescence and magnetic properties CrystEngComm 19(38) (2017) 5755-5763
Space group: P 1 2/c 1
Cell volume: 1470.37
Cell parameters: 8.0042; 11.5133; 17.4969; 90; 114.231; 90;

COD ID: 1546947
CIF file	Formula: - C44 H38 Si - Comments: Lee, Jiwon; Park, Yoona; Jung, Joori; Han, Won-Sik Blue-Shifted Aggregation-Induced Emission of Siloles by Simple Structural Modification and Their Application as Nitro Explosive Chemosensor Photochem. Photobiol. Sci. (2017) Space group: P 1 2/c 1 Cell volume: 1692.6 Cell parameters: 8.6135; 10.2226; 19.2641; 90; 93.739; 90;

COD ID: 1547112

Formula: - C34 H31 Br N2 O4 -
Comments: Kang, Zhenghui; Zhang, Dan; Hu, Wenhao Regio- and Diastereoselective Three-Component Reactions via Trapping of Ammonium Ylides with N-Alkylquinolinium Salts: Synthesis of Multisubstituted Tetra- and Dihydroquinoline Derivatives. Organic letters 19(14) (2017) 3783-3786
Space group: P 1 2/c 1
Cell volume: 2926.88
Cell parameters: 12.1984; 10.6577; 23.0168; 90; 102.007; 90;

COD ID: 1548025
CIF file	Formula: - C34 H50 N7 O20 Pt3 - Comments: Christopher H. Hendon; Aron Walsh; Norinobu Akiyama; Yosuke Konno; Takashi Kajiwara; Tasuku Ito; Hiroshi Kitagawa; Ken Sakai One-dimensional Magnus-type platinum double salts Nature Communications 7 (2016) 11950 Space group: P 1 2/c 1 Cell volume: 2250 Cell parameters: 12.158; 10.943; 16.944; 90; 93.548; 90;

COD ID: 1548316

Formula: - C61 H141 K8 Mo18 N7 O99 S18 -
Comments: Hong-Ying Zang; Andreu Ruiz de la Oliva; Haralampos N. Miras; De-Liang Long; Roy T. McBurney; Leroy Cronin Discovery of gigantic molecular nanostructures using a flow reaction array as a search engine Nature Communications 5 (2014) 3715
Space group: P 1 2/c 1
Cell volume: 18470.3
Cell parameters: 30.5759; 17.0735; 38.4463; 90; 113.034; 90;

COD ID: 1548659

Formula: - C78 H78 B2 Fe2 N8 O2 P2 Zn2 -
Comments: Abubekerov, Mark; Wei, Junnian; Swartz, Kevin R.; Xie, Zhixin; Pei, Qibing; Diaconescu, Paula L. Preparation of multiblock copolymers via step-wise addition of l-lactide and trimethylene carbonate. Chemical science 9(8) (2018) 2168-2178
Space group: P 1 2/c 1
Cell volume: 3912.1
Cell parameters: 13.855; 9.378; 30.742; 90; 101.648; 90;

COD ID: 1549535
CIF file	Formula: - C13 H18 Cu2 N O12 - Comments: Köferstein, Roberto; Robl, Christian Synthesis and Crystal Structure of Two CuII-benzene-1,2,4,5-tetracarboxylates with Three-Dimensional Open Frameworks Zeitschrift für anorganische und allgemeine Chemie 640(2) (2014) 310 Space group: P 1 2/c 1 Cell volume: 1866.8 Cell parameters: 11.5934; 10.5944; 15.822; 90; 106.13; 90;

COD ID: 1549779

Formula: - C25 H24 N4 O3 S -
Comments: El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M. Ethyl 2-anilino-4-methyl-5-[5-methyl-1-(4-methylphenyl)-1H-1,2,3-triazole-4-carbonyl]thiophene-3-carboxylate IUCrData 3(8) (2018) x181106
Space group: P 1 2/c 1
Cell volume: 2350.7
Cell parameters: 8.3287; 13.8956; 20.3124; 90; 90.635; 90;

COD ID: 1549934

Formula: - C114 H108 N16 O12 -
Comments: Qu, Hang; Tang, Xiao; Wang, Xinchang; Li, Zhihao; Huang, Zheyu; Zhang, Hui; Tian, Zhongqun; Cao, Xiaoyu Chiral molecular face-rotating sandwich structures constructed through restricting the phenyl flipping of tetraphenylethylene. Chemical science 9(47) (2018) 8814-8818
Space group: P 1 2/c 1
Cell volume: 10593.6
Cell parameters: 26.0567; 14.2086; 28.6868; 90; 94.091; 90;

COD ID: 1549957

Formula: - C77 H77 Au Cl2 Sb4 -
Comments: Li, Ying-Zhou; Ganguly, Rakesh; Hong, Kar Yiu; Li, Yongxin; Tessensohn, Malcolm Eugene; Webster, Richard; Leong, Weng Kee Stibine-protected Au13 nanoclusters: syntheses, properties and facile conversion to GSH-protected Au25 nanocluster. Chemical science 9(46) (2018) 8723-8730
Space group: P 1 2/c 1
Cell volume: 7009.6
Cell parameters: 24.5859; 11.8194; 26.9019; 90; 116.277; 90;

COD ID: 1550977
CIF file	Formula: - C65 H99 B2 Fe N7 O3 - Comments: Kiernicki, John J.; Shanahan, James P.; Zeller, Matthias; Szymczak, Nathaniel K. Tuning ligand field strength with pendent Lewis acids: access to high spin iron hydrides Chemical Science (2019) Space group: P 1 2/c 1 Cell volume: 3029.7 Cell parameters: 12.0303; 11.0429; 22.8724; 90; 94.3767; 90;

COD ID: 1551448
CIF file HKL data	Formula: - C24 H10 Br4 - Comments: Niko Pavlicek; Przemyslaw Gawel; Daniel R. Kohn; Zsolt Majzik; Yaoyao Xiong; Gerhard Meyer; Harry L. Anderson; Leo Gross Polyyne formation via skeletal rearrangement induced by atomic manipulation Nature Chemistry 10 (2018) 853-858 Space group: P 1 2/c 1 Cell volume: 1036.58 Cell parameters: 12.0069; 3.9729; 22.0798; 90; 100.208; 90;

COD ID: 1551488

Formula: - C57 H33 F10 N6 O3 -
Comments: Jackson D. Megiatto Jr; Dalvin D. Mendez-Hernandez; Marely E. Tejeda-Ferrari; Anne-Lucie Teillout; Manuel J. Llansola-Portoles; Gerdenis Kodis; Oleg G. Poluektov; Tijana Rajh; Vladimiro Mujica; Thomas L. Groy; Devens Gust; Thomas A. Moore; Ana L. Moore A bioinspired redox relay that mimics radical interactions of the Tyr-His pairs of photosystem II Nature Chemistry 6 (2014) 423-428
Space group: P 1 2/c 1
Cell volume: 6169
Cell parameters: 19.934; 10.691; 29.55; 90; 101.58; 90;

COD ID: 1551520

Formula: - C23 H23 Cl2 N7 S2 Zn -
Comments: Yu, Ping; Deng, Jungang; Cai, Jinhua; Zhang, Zhenlei; Zhang, Juzheng; Hamid Khan, Muhammad; Liang, Hong; Yang, Feng Anticancer and biological properties of a Zn-2,6-diacetylpyridine bis(thiosemicarbazone) complex. Metallomics : integrated biometal science 11(8) (2019) 1372-1386
Space group: P 1 2/c 1
Cell volume: 2553
Cell parameters: 20.55; 7.366; 17.52; 90; 105.71; 90;

COD ID: 1551527
CIF file	Formula: - C19 H26 Cl2 N2 O8 - Comments: MIKURIYA, Masahiro; KOYAMA, Yoshiki; MITSUHASHI, Ryoji Synthesis and Crystal Structure of 1,3-Bis(5-chloro-3-methoxysalicylideneamino)-2-propanol Trihydrate X-ray Structure Analysis Online 35 (2019) 33 Space group: P 1 2/c 1 Cell volume: 1106 Cell parameters: 18.098; 4.3275; 14.572; 90; 104.283; 90;

COD ID: 1551629
CIF file	Formula: - C16 H17 N O4 S2 - Comments: IGARASHI, Ryota; NAGASE, Hiromasa; FURUISHI, Takayuki; TOMONO, Kazuo; ENDO, Tomohiro; UEDA, Haruhisa Crystal Structure of an Epalrestat Methanol Solvate X-ray Structure Analysis Online 31 (2015) 1 Space group: P 1 2/c 1 Cell volume: 3270.59 Cell parameters: 14.1757; 8.23382; 28.6476; 90; 102.007; 90;

COD ID: 1551866

Formula: - C40 H39 Cu3 N8 O16.5 -
Comments: Muthukumar, P.; Moon, Dohyun; Anthony, Philip Philip Copper Coordination Polymer Electrocatalyst for Strong Hydrogen Evolution Reaction Activity in Neutral Medium: Influence of Coordination Environment and Network Structure Catalysis Science & Technology (2019)
Space group: P 1 2/c 1
Cell volume: 4239.3
Cell parameters: 16.471; 13.801; 18.659; 90; 91.86; 90;

COD ID: 1552861

Formula: - C56 H80 Cl16 N16 O16 Zn4 -
Comments: Nie, Yu; Zhang, Zhi-Xu; Shi, Ping-Ping; Zhang, Wan-Ying; Ye, Qiong; Fu, Da-Wei Flexible Thin Film and Bulk Switchable Relaxor Coexisting Most Optimal 473 nm Blue Light without Blue-Light Hazard/Visual Injury The Journal of Physical Chemistry C (2019)
Space group: P 1 2/c 1
Cell volume: 2014.35
Cell parameters: 7.1661; 15.084; 19.1836; 90; 103.732; 90;

COD ID: 1553006
CIF file	Formula: - C49.5 H45 B Cl5 F4 N O P2 Ru - Comments: Zhou, Xiaoxi; Zhang, Chunhong; Lin, Yumei; He, Xumin; Zhang, Yan; Wang, Jianbo; Xia, Haiping 1,2-Migration in the reactions of ruthenium vinyl carbene with propargyl alcohols Org. Chem. Front. 1(9) (2014) 1077 Space group: P 1 2/c 1 Cell volume: 4792.7 Cell parameters: 23.3968; 10.7057; 19.1358; 90; 90.758; 90;

COD ID: 1553136
CIF file	Formula: - C14 H14 N2 O3 - Comments: Zhang, Duo; Cui, Xiuling; Yang, Fangfang; Zhang, Qianqian; Zhu, Yu; Wu, Yangjie Palladium-catalyzed direct ortho C‒O bond construction of azoxybenzenes with carboxylic acids and alcohols Organic Chemistry Frontiers 2(8) (2015) 951 Space group: P 1 2/c 1 Cell volume: 2700.6 Cell parameters: 12.8276; 8.4882; 24.8068; 90; 91.044; 90;

COD ID: 1553221
CIF file	Formula: - C14 H12 O3 - Comments: Cai, Shujun; Xiao, Zheming; Ou, Jinjie; Shi, Yingbo; Gao, Shuanhu A photo-induced C‒C bond formation methodology to construct tetrahydrofluorenones and their related structures Organic Chemistry Frontiers 3(3) (2016) 354 Space group: P 1 2/c 1 Cell volume: 2154.92 Cell parameters: 15.9874; 10.2887; 13.7969; 90; 108.28; 90;

COD ID: 1553555

Formula: - C20 H19 I O Se -
Comments: Pistoia, Renan P.; Roehrs, Juliano A.; Back, Davi F.; Zeni, Gilson Iodine-mediated regioselective 5-endo-dig electrophilic cyclization reaction of selenoenynes: synthesis of selenophene derivatives Organic Chemistry Frontiers 4(2) (2017) 277
Space group: P 1 2/c 1
Cell volume: 1846.87
Cell parameters: 19.0809; 5.7136; 17.2112; 90; 100.175; 90;

COD ID: 1555384

Formula: - C30 H32 B2 F4 N4 -
Comments: Wang, Jun; Wu, Qinghua; Wang, Shaowu; Yu, Changjiang; Li, Jin; Hao, Erhong; Wei, Yun; Mu, Xiaolong; Jiao, Lijuan Conformation-Restricted Partially and Fully Fused BODIPY Dimers as Highly Stable Near-Infrared Fluorescent Dyes. Organic letters 17(21) (2015) 5360-5363
Space group: P 1 2/c 1
Cell volume: 1334.5
Cell parameters: 12.718; 8.6639; 12.342; 90; 101.101; 90;

COD ID: 1555925

Formula: - C27 H20 F O P -
Comments: Hu, Gaobo; Shan, Changkai; Chen, Weizhu; Xu, Pengxiang; Gao, Yuxing; Zhao, Yufen Copper-Catalyzed Direct Coupling of Unprotected Propargylic Alcohols with P(O)H Compounds: Access to Allenylphosphoryl Compounds under Ligand- and Base-Free Conditions. Organic letters 18(23) (2016) 6066-6069
Space group: P 1 2/c 1
Cell volume: 2762
Cell parameters: 11.104; 9.075; 27.414; 90; 91.04; 90;

COD ID: 1556087

Formula: - C37 H33.5 Ag Cl2 N2 O1.5 P3 -
Comments: Ma, Howard Z.; McKay, Alasdair I.; Mravak, Antonija; Scholz, Michael S.; White, Jonathan M.; Mulder, Roger J.; Bieske, Evan J.; Bonačić-Koutecký, Vlasta; O'Hair, Richard A. J. Structural characterization and gas-phase studies of the [Ag10H8(L)6]2+ nanocluster dication Nanoscale (2019)
Space group: P 1 2/c 1
Cell volume: 3450.27
Cell parameters: 12.7413; 12.9234; 20.9538; 90; 89.975; 90;

COD ID: 1557388
CIF file	Formula: - C56 H40 N4 O12 Zn2 - Comments: Park, In-Hyeok; Dey, Atanu; Sasaki, Kenta; Ohba, Masaaki; Lee, Shim Sung; Vittal, Jagadese J. Disappeared supramolecular isomer reappears with perylene guest IUCrJ 7(2) (2020) 324-330 Space group: P 1 2/c 1 Cell volume: 6494.2 Cell parameters: 20.1826; 18.7307; 17.1854; 90; 91.583; 90;

COD ID: 1557669

Formula: - C30 H20 F2 N2 O2 -
Comments: Wang, Haoran; Xing, Hao; Gong, Junyi; Zhang, Haoke; Zhang, Jun; Wei, Peifa; Yang, Guojian; Lam, Jacky W. Y.; Lu, Ran; Tang, Ben Zhong “Living” luminogens: light driven ACQ-to-AIE transformation accompanied with solid-state actuation Materials Horizons 7(6) (2020) 1566-1572
Space group: P 1 2/c 1
Cell volume: 4581.39
Cell parameters: 21.7576; 9.38142; 22.7647; 90; 99.6152; 90;

COD ID: 1557789
CIF file	Formula: - O2 Ti - Comments: Oliver Tschauner; Chi Ma; Antonio Lanzirotti; Matthew G. Newville Riesite, a New High Pressure Polymorph of TiO2 from the Ries Impact Structure Minerals 10 (2020) 78 Space group: P 1 2/c 1 Cell volume: 121.5 Cell parameters: 4.519; 5.503; 4.888; 90; 90.59; 90;

COD ID: 1557838
CIF file	Formula: - C72 H102 Al2 N4 - Comments: Weetman, Catherine; Porzelt, Amelie; Bag, Prasenjit; Hanusch, Franziska; Inoue, Shigeyoshi Dialumenes ‒ aryl vs. silyl stabilisation for small molecule activation and catalysis Chemical Science 11(18) (2020) 4817-4827 Space group: P 1 2/c 1 Cell volume: 3265 Cell parameters: 13.5339; 13.5131; 18.1559; 90; 100.481; 90;

COD ID: 1558065

Formula: - C26 H25.5 F3 I Ir N3 O P0.5 -
Comments: Zhang, Wen-Ying; Banerjee, Samya; Hughes, George M.; Bridgewater, Hannah E.; Song, Ji-Inn; Breeze, Ben G.; Clarkson, Guy J.; Coverdale, James P. C.; Sanchez-Cano, Carlos; Ponte, Fortuna; Sicilia, Emilia; Sadler, Peter J. Ligand-centred redox activation of inert organoiridium anticancer catalysts Chemical Science 11(21) (2020) 5466-5480
Space group: P 1 2/c 1
Cell volume: 2587.01
Cell parameters: 23.165; 7.44609; 15.706; 90; 107.268; 90;

COD ID: 1558195
CIF file	Formula: - C12 H36 Ag Br12 In N4 - Comments: Connor, Bridget A.; Biega, Raisa-Ioana; Leppert, Linn; Karunadasa, Hemamala I. Dimensional reduction of the small-bandgap double perovskite Cs<sub>2</sub>AgTlBr<sub>6</sub>. Chemical science 11(29) (2020) 7708-7715 Space group: P 1 2/c 1 Cell volume: 1741.73 Cell parameters: 8.4965; 7.8419; 26.1413; 90; 90.318; 90;

COD ID: 1558197
CIF file	Formula: - C12 H36 Ag Br12 N4 Tl - Comments: Connor, Bridget A.; Biega, Raisa-Ioana; Leppert, Linn; Karunadasa, Hemamala I. Dimensional reduction of the small-bandgap double perovskite Cs<sub>2</sub>AgTlBr<sub>6</sub>. Chemical science 11(29) (2020) 7708-7715 Space group: P 1 2/c 1 Cell volume: 1737.01 Cell parameters: 8.4673; 7.8406; 26.1647; 90; 90.312; 90;

COD ID: 1558320

Formula: - C24 H16 Co N10 S2 -
Comments: Zaworotko, Michael; Kumar, Naveen; Chang, Ze; Yu, Mei-Hui; Kumar, Amrit; O’Nolan, Daniel; Bu, Xian-He; Patyk-Kaźmierczak, Ewa; Bezrukov, Andrey A.; Mukherjee, Soumya; Wang, Shi-Qiang Crystal engineering of a rectangular sql coordination network to enable xylenes selectivity over ethylbenzene Chemical Science (2020)
Space group: P 1 2/c 1
Cell volume: 1677.5
Cell parameters: 10.1578; 11.4859; 14.985; 90; 106.365; 90;

COD ID: 1559001

Formula: - C8 H30 Cu N2 O11 -
Comments: Kotila, Sirpa; Valkonen, Jussi Copper(II) Complexes of 2-Amino-2-hydroxymethyl-1,3-propanediol. Part 1. Synthesis, Structure and Thermal Behavior of Three trans-Bis[2-amino-2-hydroxymethyl-1,3-propanediolato-(1)-O,N]copper(II) Complexes, [Cu(C4H10NO3)2], [Cu(C4H10NO3)2(H2O)] and [Cu(C4H10NO3)2].5H2O Acta Chemica Scandinavica 47 (1993) 950-956
Space group: P 1 2/c 1
Cell volume: 821.3
Cell parameters: 10.087; 6.34; 15.557; 90; 124.36; 90;

COD ID: 1559256
CIF file	Formula: - C16 H16 Cl Cu2 N6 O2 - Comments: Chevalier, Aline; Osypenko, Artem; Lehn, Jean-Marie; Meyer, Daniel Phase transfer of metal cations by induced dynamic carrier agents: biphasic extraction based on dynamic covalent chemistry Chemical Science (2020) Space group: P 1 2/c 1 Cell volume: 918.42 Cell parameters: 9.369; 8.7013; 12.1951; 90; 112.512; 90;

COD ID: 1559772

Formula: - C54 H38 F8 N4 -
Comments: Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science 12(6) (2020) 2181-2188
Space group: P 1 2/c 1
Cell volume: 2140.25
Cell parameters: 19.158; 6.7794; 17.4666; 90; 109.362; 90;

COD ID: 1559781

Formula: - C54 H38 F8 N4 -
Comments: Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science 12(6) (2020) 2181-2188
Space group: P 1 2/c 1
Cell volume: 2130.24
Cell parameters: 19.1368; 6.7789; 17.4066; 90; 109.373; 90;

COD ID: 1559783

Formula: - C54 H38 F8 N4 -
Comments: Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science 12(6) (2020) 2181-2188
Space group: P 1 2/c 1
Cell volume: 2161.35
Cell parameters: 19.2225; 6.7835; 17.5663; 90; 109.337; 90;

COD ID: 1559784

Formula: - C54 H38 F8 N4 -
Comments: Navarro-Huerta, Armando; Jellen, Marcus J.; Arcudia, Jessica; Teat, Simon J.; Toscano, Rubén A; Merino, Gabriel; Rodríguez-Molina, Braulio Tailoring the cavities of hydrogen-bonded amphidynamic crystals using weak contacts: towards faster molecular machines. Chemical science 12(6) (2020) 2181-2188
Space group: P 1 2/c 1
Cell volume: 2178.67
Cell parameters: 19.2767; 6.7799; 17.6615; 90; 109.29; 90;

COD ID: 1559838
CIF file	Formula: - B7 K9 Li3 Nd3 O21 - Comments: Chen, Pengyun; Xia, Mingjun; Li, Rukang Mixed Alkali Neodymium Orthoborates: K9 Li3 Nd3 (BO3 )7 and A 2 LiNd(BO3 )2 (A = Rb, Cs) Zeitschrift für anorganische und allgemeine Chemie 642(5) (2016) 424-430 Space group: P 1 2/c 1 Cell volume: 1210.74 Cell parameters: 11.4524; 10.1266; 12.3116; 90; 122.009; 90;

COD ID: 1559855

Formula: - C45 H50 B2 Fe N10 O -
Comments: Nurdin, Lucie; Yang, Yan; Neate, Peter G. N.; Piers, Warren E.; Maron, Laurent; Neidig, Michael L.; Lin, Jian-Bin; Gelfand, Benjamin S. Activation of ammonia and hydrazine by electron rich Fe(ii) complexes supported by a dianionic pentadentate ligand platform through a common terminal Fe(iii) amido intermediate. Chemical science 12(6) (2020) 2231-2241
Space group: P 1 2/c 1
Cell volume: 10570.5
Cell parameters: 18.7182; 24.1607; 23.662; 90; 98.957; 90;

COD ID: 1559995

Formula: - C29 H17 F4 N3 O Pt -
Comments: Maisuls, Iván; Wang, Cui; Gutierrez Suburu, Matias E.; Wilde, Sebastian; Daniliuc, Constantin-Gabriel; Brünink, Dana; Doltsinis, Nikos L.; Ostendorp, Stefan; Wilde, Gerhard; Kösters, Jutta; Resch-Genger, Ute; Strassert, Cristian A. Ligand-controlled and nanoconfinement-boosted luminescence employing Pt(ii) and Pd(ii) complexes: from color-tunable aggregation-enhanced dual emitters towards self-referenced oxygen reporters Chemical Science 12(9) (2021) 3270-3281
Space group: P 1 2/c 1
Cell volume: 4537.52
Cell parameters: 22.8339; 9.8626; 22.7576; 90; 117.704; 90;

COD ID: 1560381

Formula: - C46 H37 Cd3 N10 O20 -
Comments: Shi, Chenjie; Wang, Zikai; Chen, Yifan; Zhang, Xiaoyu; Zhao, Yue; Tao, Yuehong; Wu, Hua Structural diversity of four coordination polymers based on 5-nitro-1,2,3-benzenetricarboxylic acid (H3nbta): Solvothermal syntheses, structural characterizations and properties Journal of Solid State Chemistry 253 (2017) 35-42
Space group: P 1 2/c 1
Cell volume: 4884.1
Cell parameters: 18.7074; 9.1703; 28.5497; 90; 94.276; 90;

COD ID: 1561000

Formula: - C84 H66 N8 Ni2 O17 Si2 -
Comments: Li, Qi; Guo, Tiantian; Lv, Xin; Lin, Yifang; Dai, Zhihui; Fang, Min; Bao, Jianchun; Wu, Yong Two Ni(II) semiconducting metal-organic frameworks based on the tetrakis(4-carboxyphenyl)silane and an imidazole ligand: Syntheses, characterization, water stability and photoelectric properties Journal of Solid State Chemistry 265 (2018) 100-108
Space group: P 1 2/c 1
Cell volume: 2070
Cell parameters: 13.235; 8.817; 17.848; 90; 96.459; 90;

COD ID: 1561196
CIF file	Formula: - C10 H12 N6 O6 Zn - Comments: Duan, Hui; Dan, Wenyan; Fang, Xiangdong Zinc-coordinated MOFs complexes regulated by hydrogen bonds: Synthesis, structure and luminescence study toward broadband white-light emission Journal of Solid State Chemistry 260 (2018) 159-164 Space group: P 1 2/c 1 Cell volume: 684.74 Cell parameters: 7.8496; 5.3514; 16.5895; 90; 100.705; 90;

COD ID: 1561685
CIF file	Formula: - C27 H11 Co3 O18 - Comments: Yu, Xianglin; Toh, Yong Siang; Zhao, Jun; Nie, Lina; Ye, Kaiqi; Wang, Yue; Li, Dongsheng; Zhang, Qichun Surfactant-thermal method to prepare two new cobalt metal-organic frameworks Journal of Solid State Chemistry 232 (2015) 14-18 Space group: P 1 2/c 1 Cell volume: 1585.05 Cell parameters: 9.5837; 12.643; 13.9294; 90; 110.093; 90;

COD ID: 1561744

Formula: - C74 H66 N10 Ni3 O30.5 S2 -
Comments: Feng, Xun; Liu, Jing; Li, Jin; Ma, Lu-Fang; Wang, Li-Ya; Ng, Seik-Weng; Qin, Guo-Zhan Series of coordination polymers based on 4-(5-sulfo-quinolin-8-yloxy) phthalate and bipyridinyl coligands: Structure diversity and properties Journal of Solid State Chemistry 230 (2015) 80-89
Space group: P 1 2/c 1
Cell volume: 3881
Cell parameters: 15.291; 11.235; 24.984; 90; 115.28; 90;

COD ID: 1561824

Formula: - C22 H14 Br4 Cd N4 O4 -
Comments: Zhang, Xiaowei; Xing, Peiqi; Geng, Xiujuan; Sun, Daofeng; Xiao, Zhenyu; Wang, Lei Transition metal coordination polymers based on tetrabromoterephthalic and bis(imidazole) ligands: Syntheses, structures, topological analysis and photoluminescence properties Journal of Solid State Chemistry 229 (2015) 49-61
Space group: P 1 2/c 1
Cell volume: 2827.97
Cell parameters: 18.3022; 8.84836; 17.5015; 90; 93.8224; 90;

COD ID: 1561879

Formula: - C55 H55 Ag5 B5 F20 N15 O10 -
Comments: Kuai, Hai-Wei; Cheng, Xiao-Chun; Li, Deng-Hao; Hu, Tao; Zhu, Xiao-Hong Syntheses, characterization and properties of silver, copper and palladium complexes from bis(oxazoline)-containing ligands Journal of Solid State Chemistry 228 (2015) 65-75
Space group: P 1 2/c 1
Cell volume: 3518
Cell parameters: 14.9539; 11.532; 20.406; 90; 91.324; 90;

COD ID: 1561946

Formula: - C8 H22 Cl2 N4 O9 Zn -
Comments: Ichimaru, Yoshimi; Kato, Koichi; Kurosaki, Hiromasa; Fujioka, Haruto; Sakai, Misa; Yamaguchi, Yoshihiro; Wanchun, Jin; Sugiura, Kirara; Imai, Masanori; Koike, Tohru Aqua(1,4,7,10-tetraazacyclododecane)zinc(II) bis(perchlorate) IUCrData 6(4) (2021)
Space group: P 1 2/c 1
Cell volume: 1674.33
Cell parameters: 12.3428; 8.4603; 16.0543; 90; 92.881; 90;

COD ID: 1562076
CIF file	Formula: - C92 H86 Cu4 N16 O23 S2 - Comments: Kuai, Hai-Wei; Lv, Gao-Chao; Hou, Chao; Sun, Wei-Yin Anion-controlled assembly of metal 3,5-bis(benzimidazol-1-ylmethyl) benzoate complexes: Synthesis, characterization and property Journal of Solid State Chemistry 223 (2015) 2-16 Space group: P 1 2/c 1 Cell volume: 2287.3 Cell parameters: 8.7238; 11.396; 23.211; 90; 97.59; 90;

COD ID: 1562336

Formula: - C20 H20 Cl2 Cu N6 O5 -
Comments: Xiong, Pingping; Li, Jie; Bu, Huaiyu; Wei, Qing; Zhang, Ruolin; Chen, Sanping Copper(II) complexes with 4-(1H-1, 2, 4-trizol-1-ylmethyl) benzoic acid: Syntheses, crystal structures and antifungal activities Journal of Solid State Chemistry 215 (2014) 292-299
Space group: P 1 2/c 1
Cell volume: 1126.8
Cell parameters: 17.899; 8.0675; 7.84; 90; 95.565; 90;

COD ID: 1562487
CIF file	Formula: - C38 H30 Co2 N4 O8 - Comments: Jia, Li-Na; Zhao, Yang; Hou, Lei; Cui, Lin; Wang, Hai-Hua; Wang, Yao-Yu An interpenetrated pillared-layer MOF: Synthesis, structure, sorption and magnetic properties Journal of Solid State Chemistry 210(1) (2014) 251-255 Space group: P 1 2/c 1 Cell volume: 5529 Cell parameters: 20.71; 15.286; 17.893; 90; 102.56; 90;

COD ID: 1562605

Formula: - C14 H10 N O4 Zn -
Comments: Liu, Guang-Zhen; Li, Xiao-Dong; Xin, Ling-Yun; Li, Xiao-Ling; Wang, Li-Ya Diverse assemblies of the (4,4) grid layers exemplified in Zn(II)/Co(II) coordination polymers with dual linear ligands Journal of Solid State Chemistry 203 (2013) 106-113
Space group: P 1 2/c 1
Cell volume: 1425.3
Cell parameters: 10.0129; 14.0992; 11.0454; 90; 113.927; 90;

COD ID: 1563297

Formula: - C24 H26 Co3 N2 O12 -
Comments: Gu, Jin-Zhong; Lv, Dong-Yu; Gao, Zhu-Qing; Liu, Jian-Zhao; Dou, Wei; Tang, Yu Synthesis, structures, luminescent and magnetic properties of four coordination polymers with the flexible 1,3-phenylenediacetate ligands Journal of Solid State Chemistry 184(3) (2011) 675-683
Space group: P 1 2/c 1
Cell volume: 2598.7
Cell parameters: 23.315; 9.7287; 11.8332; 90; 104.487; 90;

COD ID: 1563540

Formula: - O4 Sc0.67 W -
Comments: Varga, Tamas; Mitchell, J.F.; Wang, Jun; Arnold, Lindsay G.; Toby, Brian H.; Malliakas, Christos D. High-pressure synthesis, crystal and electronic structures of a new scandium tungstate, Sc0.67WO4 Journal of Solid State Chemistry 183(7) (2010) 1567-1573
Space group: P 1 2/c 1
Cell volume: 137.86
Cell parameters: 4.80282; 5.75801; 4.98611; 90; 91.1775; 90;

COD ID: 1564002

Formula: - C47 H56 Cl4 Ir2 N2 O2 Se2 -
Comments: Harringer, Sophia; Matzinger, Manuel; Gajic, Natalie; Hejl, Michaela; Jakupec, Michael A.; Kandioller, Wolfgang; Keppler, Bernhard K. First insights into the novel class of organometallic compounds bearing a bidentate selenopyridone coordination motif: Synthesis, characterization, stability and biological investigations Inorganica Chimica Acta 513 (2020) 119919
Space group: P 1 2/c 1
Cell volume: 5652.4
Cell parameters: 14.9231; 16.3404; 23.6648; 90; 101.619; 90;

COD ID: 1564470

Formula: - C34 H46 N4 O14 S2 Zn -
Comments: García-García, Amalia; Echenique-Errandonea, Estitxu; Cepeda, Javier; Choquesillo-Lazarte, Duane; Seco, José M.; Salinas-Castillo, Alfonso; Sánchez-Moreno, Manuel; Méndez-Arriaga, José M.; Rodríguez-Diéguez, Antonio Photoluminescence and in vitro cytotoxicity analysis in a novel mononuclear Zn(II) coordination compound based on bumetanide Inorganica Chimica Acta 509 (2020) 119708
Space group: P 1 2/c 1
Cell volume: 1959.18
Cell parameters: 20.4487; 5.2605; 18.3325; 90; 96.546; 90;

COD ID: 1564630

Formula: - C49 H45 Cu3 N7 O8 -
Comments: Boussadia, Ahlem; Beghidja, Adel; Gali, Lynda; Beghidja, Chahrazed; Elhabiri, Mourad; Rabu, Pierre; Rogez, Guillaume Coordination properties of two new Schiff-base phenoxy-carboxylates and comparative study of their antioxidant activities Inorganica Chimica Acta 508 (2020) 119656
Space group: P 1 2/c 1
Cell volume: 2799.2
Cell parameters: 18.7592; 9.7333; 16.0077; 90; 106.724; 90;

COD ID: 1564869

Formula: - C24 H24 Cd N10 O8 -
Comments: Zhang, Hong-Bin; Zhang, Xiao-Fang; Chai, Lan-Qin; Tang, Li-Jian; Zhang, Hong-Song Zinc(II) and Cadmium(II) complexes containing imidazole ring: Structural, spectroscopic, antibacterial, DFT calculations and Hirshfeld surface analysis Inorganica Chimica Acta 507 (2020) 119610
Space group: P 1 2/c 1
Cell volume: 1319.16
Cell parameters: 11.6762; 8.0358; 15.1245; 90; 111.631; 90;

COD ID: 1564884

Formula: - C11 H19 Cu N4 O5.5 S3.5 -
Comments: Murphy, Jaime M.; Gaertner, Andrea A.E.; Owen, Amanda M.; Struder, Samantha; McMillen, Colin D.; Wetzler, Modi; Brumaghim, Julia L. Coordination complexes of methimazole with copper: Controlling redox reactions and sulfur extrusion Inorganica Chimica Acta 507 (2020) 119568
Space group: P 1 2/c 1
Cell volume: 1808.48
Cell parameters: 12.4725; 9.4873; 15.3776; 90; 96.348; 90;

COD ID: 1565189

Formula: - C58 H60 Cl8 F12 Fe N12 P2 -
Comments: Lindh, Linnea; Gordivska, Olga; Persson, Samuel; Michaels, Hannes; Fan, Hao; Chabera, Pavel; Rosemann, Nils W.; Gupta, Arvind Kumar; Benesperi, Iacopo; Uhlig, Jens; Prakash, Om; Sheibani, Esmaeil; Kjær, Kasper Skov; Boschloo, Gerrit; Yartsev, Arkady; Freitag, Marina; Lomoth, Reiner; Persson, Petter; Wärnmark, Kenneth Dye-Sensitized Solar Cells based on Fe N-heterocyclic Carbene Photosensitizers with Improved Rod-like Push-Pull Functionality Chemical Science (2021)
Space group: P 1 2/c 1
Cell volume: 3500.8
Cell parameters: 9.7153; 18.5782; 19.4324; 90; 93.53; 90;

COD ID: 1565247
CIF file	Formula: - C21 H18 Br4 Cl3 Dy N2 O3 - Comments: Yin, Xiuju; Li, Shixiong; Liao, Beiling Investigation of magneto-structural relation based on a series of mononuclear dysprosium single-ion magnets with high Oh symmetry Inorganica Chimica Acta 504 (2020) 119451 Space group: P 1 2/c 1 Cell volume: 2683 Cell parameters: 7.206; 18.089; 21.259; 90; 104.489; 90;

COD ID: 1565344

Formula: - C105 H75 Cl13 Hg2 N8 -
Comments: Godde, Bérangère; Ferlay, Sylvie; Kyritsakas, Nathalie; Hosseini, Mir Wais; Jouaiti, Abdelaziz Variations around 1D coordination polymers built from the triarylamine scaffold and Hg(II) or Cd(II) Inorganica Chimica Acta 503 (2020) 119427
Space group: P 1 2/c 1
Cell volume: 5409
Cell parameters: 12.669; 20.792; 21.234; 90; 104.749; 90;

COD ID: 1565978
CIF file	Formula: - C214 H136 Cl4 O4 - Comments: Chen, Han; Xia, Zeming; Miao, Qian Synthesis, aromatization and cavitates of an oxanorbornene-fused dibenzo[de,qr]tetracene nanobox Chemical Science 13(8) (2022) 2280-2285 Space group: P 1 2/c 1 Cell volume: 7713.3 Cell parameters: 16.922; 17.1293; 27.104; 90; 100.952; 90;

COD ID: 1565982

Formula: - C98 H102 F6 N8 O2 S5 -
Comments: Li, Guoping; Feng, Liang-Wen; Mukherjee, Subhrangsu; Jones, Leighton O.; Jacobberger, Robert M.; Huang, Wei; Young, Ryan M.; Pankow, Robert M.; Zhu, Weigang; Lu, Norman; Kohlstedt, Kevin L.; Sangwan, Vinod K.; Wasielewski, Michael R.; Hersam, Mark C.; Schatz, George C.; DeLongchamp, Dean M.; Facchetti, Antonio; Marks, Tobin J. Non-fullerene acceptors with direct and indirect hexa-fluorination afford >17% efficiency in polymer solar cells Energy & Environmental Science 15(2) (2022) 645-659
Space group: P 1 2/c 1
Cell volume: 26615.8
Cell parameters: 24.0563; 25.5964; 43.2943; 90; 93.25; 90;

COD ID: 1566874
CIF file	Formula: - C16 H14 N2 O2 - Comments: Xing, Yi; Li, Zhongyu; Baryshnikov, Glib; Shen, Shen; Ye, Danfeng; Ågren, Hans; Zhu, Liangliang Water Molecular Bridge-Induced Selective Dual Polarization in Crystals for Stable Multi-Emitter Chemical Science (2022) Space group: P 1 2/c 1 Cell volume: 1339.67 Cell parameters: 9.948; 5.7541; 23.8405; 90; 100.984; 90;

COD ID: 1566905

Formula: - C64 H50 N30 O15 Zn6 -
Comments: Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework Chemical Science 13(17) (2022) 4813-4820
Space group: P 1 2/c 1
Cell volume: 6781.3
Cell parameters: 20.5713; 15.332; 21.6572; 90; 96.891; 90;

COD ID: 1566906

Formula: - C66 H50 N30 O15 Zn6 -
Comments: Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework Chemical Science 13(17) (2022) 4813-4820
Space group: P 1 2/c 1
Cell volume: 6862.9
Cell parameters: 20.7927; 15.218; 21.7299; 90; 93.52; 90;

COD ID: 1566907

Formula: - C67 H50 N30 O15 Zn6 -
Comments: Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework Chemical Science 13(17) (2022) 4813-4820
Space group: P 1 2/c 1
Cell volume: 6846.93
Cell parameters: 20.6916; 15.2813; 21.6745; 90; 92.481; 90;

COD ID: 1566908

Formula: - C66 H50 N30 O15 Zn6 -
Comments: Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework Chemical Science 13(17) (2022) 4813-4820
Space group: P 1 2/c 1
Cell volume: 6741.1
Cell parameters: 20.5389; 15.2128; 21.6422; 90; 94.526; 90;

COD ID: 1566909

Formula: - C66 H50 N30 O15 Zn6 -
Comments: Wei, Yu-Bai; Luo, Dong; Xiong, Xiao; Huang, Yong-Liang; Xie, Mo; Lu, Weigang; Li, Dan Biomimetic mimicry of formaldehyde-induced DNA–protein crosslinks in the confined space of a metal–organic framework Chemical Science 13(17) (2022) 4813-4820
Space group: P 1 2/c 1
Cell volume: 6845.4
Cell parameters: 20.7798; 15.2345; 21.6564; 90; 93.144; 90;

COD ID: 1567081

Formula: - C20 H36 B I N4 O2 -
Comments: Kuehn, Laura; Zapf, Ludwig; Werner, Luis; Stang, Martin; Würtemberger-Pietsch, Sabrina; Krummenacher, Ivo; Braunschweig, Holger; Lacôte, Emmanuel; Marder, Todd B.; Radius, Udo NHC induced radical formation via homolytic cleavage of B-B bonds and its role in organic reactions. Chemical science 13(28) (2022) 8321-8333
Space group: P 1 2/c 1
Cell volume: 2374.11
Cell parameters: 13.3858; 14.2988; 13.1709; 90; 109.65; 90;

COD ID: 1567215
CIF file	Formula: - Fe O4 W - Comments: Patil, Amitkumar R.; Dongale, Tukaram D.; Kamat, Rajanish K.; Rajpure, Keshav Y. Spray pyrolysis deposited iron tungstate memristive device for artificial synapse application Materials Today Communications 29 (2021) 102900 Space group: P 1 2/c 1 Cell volume: 135.716 Cell parameters: 4.73523; 5.74138; 4.99198; 90; 90.0801; 90;

COD ID: 1567216
CIF file	Formula: - O4 W Zn - Comments: Patil, Amitkumar R.; Dongale, Tukaram D.; Kamat, Rajanish K.; Rajpure, Keshav Y. Spray deposited zinc tungstate thin film for non-volatile memory application Materials Letters 322 (2022) 132494 Space group: P 1 2/c 1 Cell volume: 132.411 Cell parameters: 4.69482; 5.72249; 4.92885; 90; 90.6325; 90;

COD ID: 1567393

Formula: - C20 H24 Fe O6 -
Comments: Oberle, Kjersti G.; Whitman, Elizabeth L.; Jolly, Charles S.; Webster, Katherine A.; Marx, Benjamin S.; Howard, Christopher M.; Hanger, Clara A.; Ramey, Erin E.; Zou, Yutong; Lowe, Jared C.; Turlington, Mark; Turlington, Christopher R. Metallopolymers in minutes via organocatalysis at room temperature Polymer Chemistry 13(33) (2022) 4747-4751
Space group: P 1 2/c 1
Cell volume: 3725.1
Cell parameters: 34.6729; 5.8345; 19.159; 90; 106.03; 90;

COD ID: 1567535

Formula: - C28 H26 N4 O2 Zn -
Comments: D'Aniello, Sara; Laviéville, Sidonie; Santulli, Federica; Simon, Malaury; Sellitto, Michele; Tedesco, Consiglia; Thomas, Christophe M.; Mazzeo, Mina Homoleptic phenoxy-imine pyridine zinc complexes: efficient catalysts for solvent free synthesis and chemical degradation of polyesters Catalysis Science & Technology 12(20) (2022) 6142-6154
Space group: P 1 2/c 1
Cell volume: 1254.6
Cell parameters: 9.7337; 6.0539; 21.73; 90; 101.532; 90;

COD ID: 1567569

Formula: - C75 H107 F6 N4 O4 Sb U -
Comments: Löffler, Sascha T.; Hümmer, Julian; Scheurer, Andreas; Heinemann, Frank W.; Meyer, Karsten Unprecedented pairs of uranium (iv/v) hydroxido and (iv/v/vi) oxido complexes supported by a seven-coordinate cyclen-anchored tris-aryloxide ligand Chemical Science (2022)
Space group: P 1 2/c 1
Cell volume: 7363
Cell parameters: 23.6848; 12.0981; 27.9247; 90; 113.046; 90;

COD ID: 1567571

Formula: - C75 H106 F6 N4 O4 Sb U -
Comments: Löffler, Sascha T.; Hümmer, Julian; Scheurer, Andreas; Heinemann, Frank W.; Meyer, Karsten Unprecedented pairs of uranium (iv/v) hydroxido and (iv/v/vi) oxido complexes supported by a seven-coordinate cyclen-anchored tris-aryloxide ligand Chemical Science (2022)
Space group: P 1 2/c 1
Cell volume: 7338.5
Cell parameters: 23.6833; 12.0691; 27.9262; 90; 113.169; 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: 1568141

Formula: - Cu11.4 Na9.74 O2 S10 -
Comments: Zhou, Xiuquan; Kolluru, Venkata Surya Chaitanya; Xu, Wenqian; Wang, Luqing; Chang, Tieyan; Chen, Yu-Sheng; Yu, Lei; Wen, Jianguo; Chan, Maria K. Y.; Chung, Duck Young; Kanatzidis, Mercouri G. Discovery of chalcogenides structures and compositions using mixed fluxes Nature 612(7938) (2022) 72-77
Space group: P 1 2/c 1
Cell volume: 2270
Cell parameters: 20.388; 7.7841; 15.311; 90; 110.9; 90;

COD ID: 1568419

Formula: - C13 H10 Cl2 N2 O -
Comments: Bhattacharya, Biswajit; Michalchuk, Adam A. L.; Silbernagl, Dorothee; Yasuda, Nobuhiro; Feiler, Torvid; Sturm, Heinz; Emmerling, Franziska An atomistic mechanism for elasto-plastic bending in molecular crystals. Chemical science 14(13) (2023) 3441-3450
Space group: P 1 2/c 1
Cell volume: 1246.6
Cell parameters: 14.5261; 4.3104; 20.361; 90; 102.088; 90;

COD ID: 1568420

Formula: - C13 H10 Cl2 N2 O -
Comments: Bhattacharya, Biswajit; Michalchuk, Adam A. L.; Silbernagl, Dorothee; Yasuda, Nobuhiro; Feiler, Torvid; Sturm, Heinz; Emmerling, Franziska An atomistic mechanism for elasto-plastic bending in molecular crystals. Chemical science 14(13) (2023) 3441-3450
Space group: P 1 2/c 1
Cell volume: 1208.3
Cell parameters: 14.3805; 4.2807; 20.0178; 90; 101.319; 90;

COD ID: 1568602

Formula: - C34.5 H26.5 Mn2 N3.5 O9.5 S4 -
Comments: Dubskikh, Vadim A.; Kolosov, Aleksei A.; Lysova, Anna A.; Samsonenko, Denis G.; Lavrov, Alexander N.; Kovalenko, Konstantin A.; Dybtsev, Danil N.; Fedin, Vladimir P. A Series of Metal–Organic Frameworks with 2,2′-Bipyridyl Derivatives: Synthesis vs. Structure Relationships, Adsorption, and Magnetic Studies Molecules 28(5) (2023) 2139
Space group: P 1 2/c 1
Cell volume: 4002
Cell parameters: 16.206; 11.501; 22.561; 90; 107.876; 90;

COD ID: 1568699
CIF file	Formula: - C7 H5 Cl N4 - Comments: Horiuchi, Sachio; Minemawari, Hiromi; Ishibashi, Shoji Competition of polar and antipolar states hidden behind a variety of polarization switching modes in hydrogen-bonded molecular chains. Materials horizons 10(6) (2023) 2149-2159 Space group: P 1 2/c 1 Cell volume: 750.1 Cell parameters: 9.457; 11.427; 7.298; 90; 107.987; 90;

COD ID: 1568792

Formula: - Fe O4 W -
Comments: Patil, Amitkumar R.; Dongale, Tukaram D.; Namade, Lahu D.; Mohite, Santosh V.; Kim, Y.; Sutar,Santosh S.; Kamat, Rajanish K.; Rajpure, Keshav Y. Sprayed FeWO4 thin film-based memristive device with negative differential resistance effect for non-volatile memory and synaptic learning applications Journal of Colloid and Interface Science 642 (2023) 540
Space group: P 1 2/c 1
Cell volume: 139.89
Cell parameters: 4.93312; 5.7245; 4.95368; 90; 90.0857; 90;

COD ID: 1569163

Formula: - C60 H72 Co F20 N6 O4 -
Comments: Gupta, Sandeep K.; Rao, Shashank V.; Demeshko, Serhiy; Dechert, Sebastian; Bill, Eckhard; Atanasov, Mihail; Neese, Frank; Meyer, Franc Air-stable four-coordinate cobalt(ii) single-ion magnets: experimental and ab initio ligand field analyses of correlations between dihedral angles and magnetic anisotropy. Chemical science 14(23) (2023) 6355-6374
Space group: P 1 2/c 1
Cell volume: 12887.3
Cell parameters: 23.3077; 25.5036; 22.5731; 90; 106.17; 90;

COD ID: 1569410

Formula: - C12 H12 N10 O7 -
Comments: Bravetti, Federica; Tapmeyer, Lukas; Skorodumov, Kathrin; Alig, Edith; Habermehl, Stefan; Hühn, Robert; Bordignon, Simone; Gallo, Angelo; Nervi, Carlo; Chierotti, Michele R.; Schmidt, Martin U. Leucopterin, the white pigment in butterfly wings: structural analysis by PDF fit, FIDEL fit, Rietveld refinement, solid-state NMR and DFT-D. IUCrJ 10(4) (2023) 448-463
Space group: P 1 2/c 1
Cell volume: 710.28
Cell parameters: 8.0781; 4.793; 18.345; 90; 90.223; 90;

COD ID: 1569411

Formula: - C6 H5.34 N5 O3.17 -
Comments: Bravetti, Federica; Tapmeyer, Lukas; Skorodumov, Kathrin; Alig, Edith; Habermehl, Stefan; Hühn, Robert; Bordignon, Simone; Gallo, Angelo; Nervi, Carlo; Chierotti, Michele R.; Schmidt, Martin U. Leucopterin, the white pigment in butterfly wings: structural analysis by PDF fit, FIDEL fit, Rietveld refinement, solid-state NMR and DFT-D. IUCrJ 10(4) (2023) 448-463
Space group: P 1 2/c 1
Cell volume: 698.46
Cell parameters: 8.10257; 4.83656; 17.8289; 90; 88.531; 90;

COD ID: 1569754

Formula: - C132 H202 Cs2 O25 Si4 -
Comments: Lirette, Frédéric; Darvish, Ali; Zhou, Zheng; Wei, Zheng; Renn, Lukas; Petrukhina, Marina A.; Weitz, R. Thomas; Morin, Jean-François Dibenzannulated peri-acenoacenes from anthanthrene derivatives. Chemical science 14(37) (2023) 10184-10193
Space group: P 1 2/c 1
Cell volume: 6784
Cell parameters: 14.77; 19.188; 25.019; 90; 106.906; 90;

COD ID: 1569900
CIF file	Formula: - C50 H48 N8 O14 Zn - Comments: Guan, Lei; Wang, Ying; Jin, Hongzhe; Yin, Pengpeng A new route for the syntheses of coordination polymers using magnetic influence: syntheses, crystal structures and fluorescence properties. IUCrJ 10(6) (2023) Space group: P 1 2/c 1 Cell volume: 4709.2 Cell parameters: 14.1895; 14.8309; 22.402; 90; 92.676; 90;

COD ID: 1570070

Formula: - C30 H18 F2 N2 O4 Zn -
Comments: Jena, Rohan; Laha, Subhajit; Dwarkanath, Nimish; Hazra, Arpan; Haldar, Ritesh; Balasubramanian, Sundaram; Maji, Tapas Kumar Noncovalent interaction guided selectivity of haloaromatic isomers in a flexible porous coordination polymer. Chemical science 14(43) (2023) 12321-12330
Space group: P 1 2/c 1
Cell volume: 1260.86
Cell parameters: 7.8066; 9.8765; 16.3671; 90; 92.361; 90;

COD ID: 1570071

Formula: - C30 H18 F2 N2 O4 Zn -
Comments: Jena, Rohan; Laha, Subhajit; Dwarkanath, Nimish; Hazra, Arpan; Haldar, Ritesh; Balasubramanian, Sundaram; Maji, Tapas Kumar Noncovalent interaction guided selectivity of haloaromatic isomers in a flexible porous coordination polymer. Chemical science 14(43) (2023) 12321-12330
Space group: P 1 2/c 1
Cell volume: 1258.24
Cell parameters: 7.8873; 9.9771; 16.0181; 90; 93.433; 90;

COD ID: 1570073

Formula: - C30 H18 Br2 N2 O4 Zn -
Comments: Jena, Rohan; Laha, Subhajit; Dwarkanath, Nimish; Hazra, Arpan; Haldar, Ritesh; Balasubramanian, Sundaram; Maji, Tapas Kumar Noncovalent interaction guided selectivity of haloaromatic isomers in a flexible porous coordination polymer. Chemical science 14(43) (2023) 12321-12330
Space group: P 1 2/c 1
Cell volume: 1304.9
Cell parameters: 7.621; 9.8308; 17.4204; 90; 91.107; 90;

COD ID: 1570074

Formula: - C30 H18 Cl2 N2 O4 Zn -
Comments: Jena, Rohan; Laha, Subhajit; Dwarkanath, Nimish; Hazra, Arpan; Haldar, Ritesh; Balasubramanian, Sundaram; Maji, Tapas Kumar Noncovalent interaction guided selectivity of haloaromatic isomers in a flexible porous coordination polymer. Chemical science 14(43) (2023) 12321-12330
Space group: P 1 2/c 1
Cell volume: 1287.18
Cell parameters: 7.6348; 9.8825; 17.0598; 90; 90.083; 90;

COD ID: 1570076

Formula: - C30 H18 Cl2 N2 O4 Zn -
Comments: Jena, Rohan; Laha, Subhajit; Dwarkanath, Nimish; Hazra, Arpan; Haldar, Ritesh; Balasubramanian, Sundaram; Maji, Tapas Kumar Noncovalent interaction guided selectivity of haloaromatic isomers in a flexible porous coordination polymer. Chemical science 14(43) (2023) 12321-12330
Space group: P 1 2/c 1
Cell volume: 1264.91
Cell parameters: 7.5498; 9.7529; 17.1831; 90; 91.296; 90;

COD ID: 1570078

Formula: - C30 H18 Br2 N2 O4 Zn -
Comments: Jena, Rohan; Laha, Subhajit; Dwarkanath, Nimish; Hazra, Arpan; Haldar, Ritesh; Balasubramanian, Sundaram; Maji, Tapas Kumar Noncovalent interaction guided selectivity of haloaromatic isomers in a flexible porous coordination polymer. Chemical science 14(43) (2023) 12321-12330
Space group: P 1 2/c 1
Cell volume: 1274.29
Cell parameters: 7.5558; 9.7064; 17.3881; 90; 92.212; 90;

COD ID: 1570313

Formula: - C38 H46 Cl3 F3 Ge O3 P2 S -
Comments: Peddi, Balakrishna; Khan, Souvik; Gonnade, Rajesh G.; Yildiz, Cem B.; Majumdar, Moumita Intramolecular donor-stabilized tetra-coordinated germanium(iv) di-cations and their Lewis acidic properties. Chemical science 14(47) (2023) 13755-13764
Space group: P 1 2/c 1
Cell volume: 4321.1
Cell parameters: 17.954; 9.494; 26.01; 90; 102.93; 90;

COD ID: 1570315

Formula: - C41 H52 F4 Ge O4 P2 S -
Comments: Peddi, Balakrishna; Khan, Souvik; Gonnade, Rajesh G.; Yildiz, Cem B.; Majumdar, Moumita Intramolecular donor-stabilized tetra-coordinated germanium(iv) di-cations and their Lewis acidic properties. Chemical science 14(47) (2023) 13755-13764
Space group: P 1 2/c 1
Cell volume: 3990.6
Cell parameters: 17.3764; 9.2749; 25.485; 90; 103.688; 90;

COD ID: 1570417
CIF file	Formula: - C73 H57 Cl3 F14 N6 O4 - Comments: Cheng, Qiuhong; Hao, Aiyou; Xing, Pengyao Selective chiral dimerization and folding driven by arene-perfluoroarene force. Chemical science 15(2) (2024) 618-628 Space group: P 1 2/c 1 Cell volume: 6724.53 Cell parameters: 22.8294; 9.4458; 31.1842; 90; 90.301; 90;

COD ID: 1570701
CIF file	Formula: - C34 H19 B - Comments: Schnitzlein, Matthias; Shoyama, Kazutaka; Würthner, Frank A highly fluorescent bora[6]helicene exhibiting circularly polarized light emission. Chemical science 15(8) (2024) 2984-2989 Space group: P 1 2/c 1 Cell volume: 2070.5 Cell parameters: 20.652; 4.902; 21.645; 90; 109.11; 90;

COD ID: 1570834

Formula: - C6 H12 Cd Cl3 N3 -
Comments: Xiao, Guowei; Ma, Yu-Juan; Qi, Zhenhong; Fang, Xiaoyu; Chen, Tianhong; Yan, Dongpeng A flexible ligand and halogen engineering enable one phosphor-based full-color persistent luminescence in hybrid perovskitoids. Chemical science 15(10) (2024) 3625-3632
Space group: P 1 2/c 1
Cell volume: 1089.65
Cell parameters: 7.6542; 8.5911; 16.6247; 90; 94.622; 90;

COD ID: 1570835

Formula: - C6 H12 Br3 Cd N3 O0 -
Comments: Xiao, Guowei; Ma, Yu-Juan; Qi, Zhenhong; Fang, Xiaoyu; Chen, Tianhong; Yan, Dongpeng A flexible ligand and halogen engineering enable one phosphor-based full-color persistent luminescence in hybrid perovskitoids. Chemical science 15(10) (2024) 3625-3632
Space group: P 1 2/c 1
Cell volume: 1169.6
Cell parameters: 7.9948; 8.6736; 16.9504; 90; 95.696; 90;

COD ID: 1570843
CIF file	Formula: - C24 H15 N3 O3 - Comments: Pandit, Sulekha Kumari KUMARI; Das, Sanjana; Das, Gopal Self-assembled Emissive Probe for Efficient Sensing of Fe(III) and Cysteine in the Physiological Medium: Application in Real Water and Food Sample Sensors & Diagnostics (2024) Space group: P 1 2/c 1 Cell volume: 1838.7 Cell parameters: 6.774; 13.257; 20.637; 90; 97.183; 90;

COD ID: 1570917

Formula: - C45.5 H25 Al Eu F18 N3 O12 -
Comments: Gallo, Elisa; Bellucci, Luca; Carlotto, Silvia; Bottaro, Gregorio; Babetto, Luca; Giordano, Luca; Marchetti, Fabio; Samaritani, Simona; Armelao, Lidia; Labella, Luca Aluminium 8-Hydroxyquinolinate N-Oxide as a Precursor to Heterometallic Aluminium-Lanthanide Complexes. Molecules (Basel, Switzerland) 29(2) (2024) 451
Space group: P 1 2/c 1
Cell volume: 5235.6
Cell parameters: 20.3737; 12.9319; 20.6857; 90; 106.129; 90;

COD ID: 1571439
CIF file	Formula: - C22 H23 B11 - Comments: () Space group: P 1 2/c 1 Cell volume: 2143.25 Cell parameters: 11.6463; 6.9742; 26.5047; 90; 95.4; 90;

COD ID: 1571591

Formula: - Fe O4 W -
Comments: Patil, Amitkumar R.; Dongale, Tukaram D.; Pedanekar, Rupesh S.; Sutar,Santosh S.; Kamat, Rajanish K.; Rajpure, Keshav Y. Multilevel resistive switching in hydrothermally synthesized FeWO4 thin film-based memristive device for non-volatile memory application Journal of Colloid and Interface Science 669 (2024) 444
Space group: P 1 2/c 1
Cell volume: 135.347
Cell parameters: 4.7537; 5.7244; 4.9738; 90; 90.0801; 90;

COD ID: 2000730
CIF file Original IUCr paper	Formula: - C24 H24 F6 O P S16 - Comments: Bu, X.; Cisarova, I.; Coppens, P. Structure of ζ-(BEDT-TTF)~2~PF~6~.C~4~H~8~O~2~ Acta Crystallographica Section C 48(8) (1992) 1563-1565 Space group: P 1 2/c 1 Cell volume: 1834.5 Cell parameters: 8.293; 6.703; 33.02; 90; 91.87; 90;

COD ID: 2001148

Formula: - C60 H68 Cu2 N2 O8 -
Comments: Fujita, T.; Ohba, S.; Nagamatsu, M.; Tokii, T.; Jury, C. F.; Steward, O. W.; Kato, M. Dimeric copper(II) 2-methyl-2-phenylpropanoate adducts with water or 2,6-lutidine and a monomeric copper(II) triphenylacetate adduct with 2,6-lutidine Acta Crystallographica Section C 49(12) (1993) 2095-2100
Space group: P 1 2/c 1
Cell volume: 4921.1
Cell parameters: 13.033; 22.608; 16.703; 90; 90.76; 90;

COD ID: 2001453
CIF file Original IUCr paper	Formula: - C14 H12 Cl2 O6 Zn - Comments: Potočňák, I.; Dunaj-Jurčo, M.; Černák, J. Structure of diaquabis(4-chlorobenzoato)zinc(II) Acta Crystallographica Section C 49(8) (1993) 1496-1498 Space group: P 1 2/c 1 Cell volume: 1489.7 Cell parameters: 26.119; 4.989; 11.91; 90; 106.29; 90;

COD ID: 2001454
CIF file Original IUCr paper	Formula: - C36 H30 Cl I2 O P2 Re - Comments: Rossi, S.; Bélanger, S.; Lebuis, A.-M.; Beauchamp, A. L. Structure of (<i>OC</i>-6-14)-chlorodiiodooxobis(triphenylphosphine)rhenium(V) Acta Crystallographica Section C 49(8) (1993) 1498-1500 Space group: P 1 2/c 1 Cell volume: 3469 Cell parameters: 24.375; 9.791; 16.127; 90; 115.66; 90;

COD ID: 2002079
CIF file Original IUCr paper	Formula: - S8 - Comments: Gallacher, A. C.; Pinkerton, A. A. A redetermination of monclinic γ-sulfur Acta Crystallographica Section C 49(1) (1993) 125-126 Space group: P 1 2/c 1 Cell volume: 838.8 Cell parameters: 8.455; 13.052; 9.267; 90; 124.89; 90;

COD ID: 2002471
CIF file	Formula: - Ca Cu O7 V2 - Comments: Vogt, R; Mueller-Buschbaum, Hk Der Uebergang von planaren zu tetraedrischen Cu O4-Baugruppen in Ca Cu V2 O7 Zeitschrift fuer Anorganische und Allgemeine Chemie 594 (1991) 119-126 Space group: P 1 2/c 1 Cell volume: 902.1 Cell parameters: 10.0101; 8.8454; 10.1899; 90; 91.032; 90;

COD ID: 2002821
CIF file	Formula: - Ba5 Cl6 Mg0.4 Mn1.6 O14 V4 - Comments: Mueller-Buschbaum, Hk; Rettich, R Isolierte MnCl6-Oktaeder im Oxohalogeno-Vanadat Ba5 (Mg0.4 Mn0.6) (V2 O7)2 Mn Cl6 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 52 (1997) 457-461 Space group: P 1 2/c 1 Cell volume: 1106.8 Cell parameters: 13.345; 5.711; 15.859; 90; 113.69; 90;

COD ID: 2002903
CIF file	Formula: - C7 H13 N O2 - Comments: Larsen, Ingrid Kjoller; Trickey, Peter Cyclohexanecarbohydroxamic Acid Acta Crystallographica, Section C: Crystal Structure Communications 51(1) (1995) 125-127 Space group: P 1 2/c 1 Cell volume: 836.1 Cell parameters: 13.044; 6.847; 9.465; 90; 98.46; 90;

COD ID: 2003393
CIF file Original IUCr paper	Formula: - C44 H52 O10 - Comments: Pèpe, G.; Astier, J.-P.; Estienne, J.; Bressot, C.; Asfari, Z.; Vicens, J. 1,2-Bis-crown-5-calix[4]arene Acta Crystallographica Section C 51(4) (1995) 726-729 Space group: P 1 2/c 1 Cell volume: 3982.7 Cell parameters: 18.06; 10.716; 22.338; 90; 112.89; 90;

COD ID: 2003931

Formula: - C45 H77 Eu N6 O16 -
Comments: Brayshaw, P. A.; Harrowfield, J. M.; Sobolev, A. N. A Strongly Luminescent Organic-Solvent-Soluble Salt of the Tris(dipicolinato)europium(III) Trianion Acta Crystallographica Section C 51(9) (1995) 1799-1802
Space group: P 1 2/c 1
Cell volume: 5145.9
Cell parameters: 24.096; 10.692; 20.188; 90; 98.36; 90;

COD ID: 2004505
CIF file Original IUCr paper	Formula: - C10 H6 Ca O6 - Comments: Paluchowska, B.; Maurin, J. K.; Leciejewicz, J. Carboxylate and Furan-Ring Oxygen Bonded to Calcium in Polymeric Calcium Furoate Acta Crystallographica Section C 52(2) (1996) 347-351 Space group: P 1 2/c 1 Cell volume: 6275 Cell parameters: 18.262; 12.956; 26.52; 90; 90.4; 90;

COD ID: 2004725
CIF file Original IUCr paper	Formula: - C10 H20 Mo3 O17 S4 - Comments: Cotton, F. A.; Daniels, L. M.; Shang, M.; Llusar, R.; Schwotzer, W. A Trinuclear Cluster of Molybdenum(IV), Mo~3~(μ~3~-S)(μ~2~-S)~3~(HC~2~O~4~)~2~(C~2~O~4~)(H~2~O)~3~ Acta Crystallographica Section C 52(4) (1996) 835-838 Space group: P 1 2/c 1 Cell volume: 2461.1 Cell parameters: 19.403; 6.555; 19.512; 90; 97.38; 90;

COD ID: 2004910
CIF file Original IUCr paper	Formula: - C28 H42 Cl4 N2 O4 Zr2 - Comments: Polamo, M.; Mutikainen, I.; Leskelä, M. A 1:4 Adduct of Tetrachlorobis(μ-phenylimido)dizirconium(IV) and Tetrahydrofuran Acta Crystallographica Section C 52(5) (1996) 1082-1084 Space group: P 1 2/c 1 Cell volume: 1677 Cell parameters: 9.431; 11.27; 15.781; 90; 91.13; 90;

COD ID: 2005568
CIF file Original IUCr paper	Formula: - C10 H14 F6 - Comments: Swenson, D. C.; Davis, C. R.; Burton, D. J. Three 1,4-<i>trans</i>-Substituted Cyclohexanes Acta Crystallographica Section C 52(11) (1996) 2844-2847 Space group: P 1 2/c 1 Cell volume: 1061.2 Cell parameters: 8.807; 11.447; 10.644; 90; 98.54; 90;

COD ID: 2005979
CIF file Original IUCr paper	Formula: - Bi12 Mo5 O34 Pb - Comments: Enjalbert, R.; Hasselmann, G.; Galy, J. A New Mixed Oxide with (Bi~12~O~14~)~<i>n~</i> Columns: PbBi~12~Mo~5~O~34~ Acta Crystallographica Section C 53(3) (1997) 269-272 Space group: P 1 2/c 1 Cell volume: 1640.6 Cell parameters: 11.715; 5.8; 24.694; 90; 102.1; 90;

COD ID: 2006324
CIF file Original IUCr paper	Formula: - C13 H24 N2 O - Comments: Govindasamy, L.; Subramanian, E. <i>N</i>,<i>N</i>'-Dicyclohexylurea Acta Crystallographica Section C 53(7) (1997) 927-928 Space group: P 1 2/c 1 Cell volume: 648.96 Cell parameters: 11.52; 4.7; 12.04; 90; 95.44; 90;

COD ID: 2006472
CIF file Original IUCr paper	Formula: - C36 H30 Au F2 O2 P3 S2 - Comments: LeBlanc, Daren J.; Britten, James F.; Lock, Colin J.L. Bis(triphenylphosphine sulfide-<i>S</i>)gold(I) Difluorophosphate(V) Acta Crystallographica Section C 53(9) (1997) 1204-1206 Space group: P 1 2/c 1 Cell volume: 1779 Cell parameters: 13.847; 9.232; 14.681; 90; 108.57; 90;

COD ID: 2007663

Formula: - C22 H48 Fe Gd N6 O8 S8 -
Comments: Martti Klinga; Rafael Cuesta; José María Moreno; José Manuel Dominguez-Vera; Enrique Colacio; Raikko Kivekäs Octakis(dimethyl sulfoxide-O)gadolinium(III) Hexacyanoferrate(III) Acta Crystallographica Section C 54(9) (1998) 1275-1277
Space group: P 1 2/c 1
Cell volume: 2045.6
Cell parameters: 9.92; 10.631; 19.413; 90; 92.35; 90;

COD ID: 2007829
CIF file Original IUCr paper	Formula: - C12 H15 N2 O2.5 - Comments: Shyamaprosad Goswami; Reshmi Mukherjee; Gur Dayal Nigam; Kandasamy Chinnakali; Hoong-Kun Fun <i>o</i>-Phenylenediamine Pyrocatechol Hemihydrate Complex Acta Crystallographica Section C 54(11) (1998) 1647-1649 Space group: P 1 2/c 1 Cell volume: 1175.62 Cell parameters: 9.0498; 5.2275; 25.0771; 90; 97.71; 90;

COD ID: 2008227
CIF file Original IUCr paper	Formula: - Na4.5 O17.5 V7 - Comments: Millet, Patrice; Henry, Jean-Yves; Galy, Jean The vanadium oxide bronze η-Na~<i>x~</i>V~2~O~5~ (<i>x</i> = 1.286) Acta Crystallographica Section C 55(3) (1999) 276-279 Space group: P 1 2/c 1 Cell volume: 1498.8 Cell parameters: 15.181; 5.0319; 20.76; 90; 109.07; 90;

COD ID: 2009310
CIF file Original IUCr paper	Formula: - C14 H21 Cl N4 Ni O9 - Comments: Pajunen, Aarne; Orama, Marjatta; Saarinen, Heikki Diaqua{hydrogen bis[1-(2-pyridyl)ethanone oximato-<i>N</i>,<i>N</i>']}nickel(II) perchlorate hydrate Acta Crystallographica Section C 55(12) (1999) 2075-2077 Space group: P 1 2/c 1 Cell volume: 948.6 Cell parameters: 10.586; 11.925; 7.803; 90; 105.64; 90;

COD ID: 2009339

Formula: - C11 H12 Cl2 Cu S7 -
Comments: Dai, Jie; Bian, Guo-qing; Zhou, Min-Yan; Maekawa, Masahiko; Munakata, Megumu Dichloro(3,4,5,6-tetramethylthio-1,3-benzodithiazole-2-thione-S^5^,S^6^)copper(II) Acta Crystallographica Section C 55(12) (1999) IUC9900166
Space group: P 1 2/c 1
Cell volume: 1814.5
Cell parameters: 13.919; 9.211; 14.856; 90; 107.7; 90;

COD ID: 2010541

Formula: - C4 H6.33 N O4.67 -
Comments: Kolev, Tsonko; Glavcheva, Zornitza; Petrova, Rosica; Angelova, Olyana Ammonium hydrogen squarate‒water (3/2) Acta Crystallographica Section C 56(1) (2000) 110-112
Space group: P 1 2/c 1
Cell volume: 899
Cell parameters: 10.031; 8.2799; 10.968; 90; 99.274; 90;

COD ID: 2010985

Formula: - B3 Ga2 Li2 O9 Rb -
Comments: Judith L. Kissick; Douglas A. Keszler RbLi~2~Ga~2~(BO~3~)~3~ Acta Crystallographica Section C 56(6) (2000) 631-632
Space group: P 1 2/c 1
Cell volume: 397.4
Cell parameters: 6.297; 4.951; 12.751; 90; 91.65; 90;

COD ID: 2011217

Formula: - Ce N5 Na2 O16 -
Comments: Audebrand, Nathalie; Louër, Daniel Cerous sodium nitrate monohydrate, Na~2~Ce(NO~3~)~5~·H~2~O Acta Crystallographica Section C 56(8) (2000) 913-915
Space group: P 1 2/c 1
Cell volume: 2575.9
Cell parameters: 21.387; 7.9328; 15.184; 90; 90.657; 90;

COD ID: 2012121
CIF file Original IUCr paper	Formula: - Li3 O4 Sb - Comments: Bernès, Sylvain; Trujillo Tovar, Sonia; Castellanos R., María A. A comparison of the X-ray single-crystal structure of Li~3~SbO~4~ with the Rietveld refinement Acta Crystallographica Section C 57(8) (2001) 883-884 Space group: P 1 2/c 1 Cell volume: 151.84 Cell parameters: 5.1456; 6.0794; 5.1291; 90; 108.859; 90;

COD ID: 2012256

Formula: - C16 H17 Cl N4 O11 -
Comments: Alfonso, Montserrat; Wang, Yi; Stoeckli-Evans, Helen Hydrogen bonding in the inner-salt zwitterion and in two different charged forms of 5,6-bis(2-pyridyl)pyrazine-2,3-dicarboxylic acid Acta Crystallographica Section C 57(10) (2001) 1184-1188
Space group: P 1 2/c 1
Cell volume: 984.13
Cell parameters: 6.1401; 15.6358; 10.7154; 90; 106.934; 90;

COD ID: 2012257

Formula: - C16 H17 F6 N4 O7 P -
Comments: Alfonso, Montserrat; Wang, Yi; Stoeckli-Evans, Helen Hydrogen bonding in the inner-salt zwitterion and in two different charged forms of 5,6-bis(2-pyridyl)pyrazine-2,3-dicarboxylic acid Acta Crystallographica Section C 57(10) (2001) 1184-1188
Space group: P 1 2/c 1
Cell volume: 1007.48
Cell parameters: 6.191; 15.6564; 10.8349; 90; 106.4; 90;

COD ID: 2012333

Formula: - K3 O4 Sb -
Comments: Hirschle, Christian; Rosstauscher, Jürgen; Röhr, Caroline Potassium oxoantimonate(V), K~3~[SbO~4~] Acta Crystallographica Section C 57(11) (2001) 1239-1241
Space group: P 1 2/c 1
Cell volume: 195.33
Cell parameters: 5.7971; 6.5933; 5.4179; 90; 109.394; 90;

COD ID: 2012729

Formula: - C12 H24 Cl2 Co N4 S2 -
Comments: Castro, Jesús; Pérez Lourido, Paulo; Sousa-Pedrares, Antonio; Labisbal, Elena; Piso, José; García-Vázquez, José Arturo Dichlorobis(1-propylimidazolidine-2-thione-κS)cobalt(II) Acta Crystallographica Section C 58(5) (2002) m319-m322
Space group: P 1 2/c 1
Cell volume: 1956.6
Cell parameters: 15.684; 8.64; 14.916; 90; 104.528; 90;

COD ID: 2013129

Formula: - C4 H8 Ca O10 P2 -
Comments: Ślepokura, Katarzyna; Lis, Tadeusz Polymeric bis(phosphonomethylcarboxylato)calcium(II) at 85K Acta Crystallographica Section C 59(3) (2003) m76-m78
Space group: P 1 2/c 1
Cell volume: 506.7
Cell parameters: 13.021; 5.516; 7.358; 90; 106.5; 90;

COD ID: 2013381

Formula: - C16 H31 Ag4 Cu2 N13 O2 -
Comments: Potočňák, Ivan; Triščíková, Ľubica; Wagner, Christoph Low-dimensional compounds containing cyano groups. VI. A unique two- and one-dimensional structure in amminebis(1,4-diaminobutane)tetrakis[dicyanoargentato(I)]dicopper(II) dihydrate Acta Crystallographica Section C 59(6) (2003) m249-m251
Space group: P 1 2/c 1
Cell volume: 1523
Cell parameters: 9.862; 16.541; 10.21; 90; 113.84; 90;

COD ID: 2013528

Formula: - C32 H20 Co2 N4 O8 -
Comments: Jian-Fang Ma; Jin Yang; Jing-Fu Liu A novel cobalt(II) coordination polymer containing the fumarate anion and o-phenanthroline Acta Crystallographica Section C 59(8) (2003) m304-m306
Space group: P 1 2/c 1
Cell volume: 2788.3
Cell parameters: 12.264; 10.111; 22.65; 90; 96.89; 90;

COD ID: 2013688

Formula: - C49.196 H24 B Cl6.392 D2.392 F20 Li N4 Pd2 -
Comments: Han Shen; Ian M. Steele; Richard F. Jordan Tetra-μ-chloro-1:2κ^4^Cl;1:3κ^4^Cl-bis(4,4'-dimethyl-2,2'-bipyridine)-2κ^2^N,3κ^2^N-lithium(I)dipalladium(II) tetrakis(pentafluorophenyl)borate dichloromethane 1.196-solvate Acta Crystallographica Section C 59(10) (2003) m405-m406
Space group: P 1 2/c 1
Cell volume: 5573
Cell parameters: 22.361; 7.939; 31.754; 90; 98.621; 90;

COD ID: 2013765

Formula: - C6 H12 O4 -
Comments: Gelalcha, Feyissa Gadissa; Schulze, Bärbel; Lönnecke, Peter 3,3,6,6-Tetramethyl-1,2,4,5-tetroxane: a twinned crystal structure Acta Crystallographica Section C 60(3) (2004) o180-o182
Space group: P 1 2/c 1
Cell volume: 370.05
Cell parameters: 5.9194; 5.9245; 10.5821; 90; 94.326; 90;

COD ID: 2013933

Formula: - C35 H29 N3 O4 -
Comments: Steel, Peter J.; Brimble, Margaret A.; Hopkins, Brian; Rennison, David Two stereoisomers of the rat toxicant norbormide Acta Crystallographica Section C 60(5) (2004) o374-o376
Space group: P 1 2/c 1
Cell volume: 2771.9
Cell parameters: 17.999; 12.614; 13.063; 90; 110.834; 90;

COD ID: 2014197
CIF file Original IUCr paper	Formula: - C3 H3 N3 O2 S - Comments: Jacek Zaleski; Grzegorz Spaleniak; Kyzioł, Janusz B. <i>N</i>-(3<i>H</i>-Thiazol-2-ylidene)nitramine and <i>N</i>-methyl-<i>N</i>-(thiazol-2-yl)nitramine Acta Crystallographica Section C 60(9) (2004) o627-o629 Space group: P 1 2/c 1 Cell volume: 1055.3 Cell parameters: 18.737; 3.727; 16.617; 90; 114.57; 90;

COD ID: 2014480

Formula: - C23 H28 Co N2 O4 -
Comments: Zhi, Xin-Lei; Zhang, Wen-Hua; Zhang, Yong; Lang, Jian-Ping catena-Poly[[bis(pentane-2,4-dionato-κ^2^O,O')cobalt(II)]-μ-4,4'-methylenedianiline-κ^2^N:N'] Acta Crystallographica Section C 60(11) (2004) m554-m556
Space group: P 1 2/c 1
Cell volume: 1096.18
Cell parameters: 5.5805; 8.9808; 21.955; 90; 94.976; 90;

COD ID: 2015357
CIF file Original IUCr paper	Formula: - C24 H80 I18 N8 Pb5 - Comments: Billing, David G.; Lemmerer, Andreas Octakis(3-propylammonium) octadecaiodopentaplumbate(II): a new layered stucture based on layered perovskites Acta Crystallographica Section C 62(6) (2006) m238-m240 Space group: P 1 2/c 1 Cell volume: 7937 Cell parameters: 23.988; 8.754; 37.986; 90; 95.718; 90;

COD ID: 2015361

Formula: - C4 H6 Cl Cu N10 -
Comments: Lyakhov, Alexander S.; Serebryanskaya, Tatiyana V.; Gaponik, Pavel N.; Voitekhovich, Sergei V.; Ivashkevich, Ludmila S. Bis(1-methyl-1H-tetrazol-5-yl)diazene and two its copper(I) chloride complexes poly[[[μ-1,2-bis(1-methyl-1H-tetrazol-5-yl)diazene-κ^4^N',N^4^:N,N^4'^]dicopper(I)]-di-μ-chloro] and catena-poly[[chlorocopper(I)]-μ-1,2-bis(1-methyl-1H-tetrazol-5-yl)diazene-κ^4^N',N^4^:N,N^4'^] Acta Crystallographica Section C 62(6) (2006) m223-m226
Space group: P 1 2/c 1
Cell volume: 516.4
Cell parameters: 8.528; 6.2456; 10.059; 90; 105.462; 90;

COD ID: 2015413

Formula: - C7 H14 F6 N6 O7 -
Comments: Genivaldo Júlio Perpétuo; Jan Janczak Two crystals of doubly protonated melaminium salts: melaminium bis(trifluoroacetate) trihydrate and melaminium bis(trichloroacetate) dihydrate Acta Crystallographica Section C 62(7) (2006) o372-o375
Space group: P 1 2/c 1
Cell volume: 794.2
Cell parameters: 12.442; 8.333; 7.66; 90; 90.14; 90;

COD ID: 2015955

Formula: - C14 H14 Ca N2 O14 -
Comments: Yasodha, Vaduganathan; Govindarajan, Subbaiah; Low, John N.; Glidewell, Christopher Cationic, neutral and anionic metal(II) complexes derived from 4-oxo-4H-pyran-2,6-dicarboxylic acid (chelidonic acid) Acta Crystallographica Section C 63(5) (2007) m207-m215
Space group: P 1 2/c 1
Cell volume: 854.88
Cell parameters: 6.4669; 7.0797; 18.8278; 90; 97.372; 90;

COD ID: 2015974

Formula: - C14 H12 O8 S Zn -
Comments: Peng-Bin Pan; Lei Zhang; Zhao-Ji Li; Xin-Yi Cao; Yuan-Gen Yao catena-Poly[[diaquazinc(II)]-μ-4,4'-sulfonyldibenzoato-κ^2^O:O'] Acta Crystallographica Section C 63(6) (2007) m270-m272
Space group: P 1 2/c 1
Cell volume: 727.95
Cell parameters: 13.307; 5.0336; 12.1142; 90; 116.218; 90;

COD ID: 2016361

Formula: - C9 H13 La2 N O16 -
Comments: Wang, Jingen; Huang, Xihe; Huang, Changcang; Song, Haiyan; Yang, Duoping A new three-dimensional neutral framework of lanthanum oxalate: [La~2~(C~2~O~4~)~3~(DMF)(H~2~O)~3~]~n~ Acta Crystallographica Section C 63(12) (2007) m583-m585
Space group: P 1 2/c 1
Cell volume: 872.4
Cell parameters: 10.392; 10.224; 8.7073; 90; 109.43; 90;

COD ID: 2016410

Formula: - C33 H26 Au O P S10 -
Comments: Wang, Xin-Qiang; Yu, Wen-Tao; Xu, Dong; Fan, Jian-Dong; Zhang, Guang-Hui; Ren, Quan Tetraphenylphosphonium bis(2-thioxo-1,3-dithiole-4,5-dithiolato)aurate(III) acetone solvate and ethyltriphenylphosphonium bis(2-thioxo-1,3-dithiole-4,5-dithiolato)aurate(III) Acta Crystallographica Section C 64(1) (2008) m46-m49
Space group: P 1 2/c 1
Cell volume: 3795.78
Cell parameters: 24.4198; 7.4511; 23.1654; 90; 115.772; 90;

COD ID: 2016418

Formula: - C12 H8 N2 O4 S2 Zn -
Comments: Yong Wang; Dong-Xia Zhu; Zhong-Min Su; Kui-Zhan Shao; Ya-Hui Zhao A novel two-dimensional zinc(II) coordination polymer with 6-mercaptonicotinic acid Acta Crystallographica Section C 64(1) (2008) m70-m72
Space group: P 1 2/c 1
Cell volume: 1357.54
Cell parameters: 13.4079; 6.5765; 16.039; 90; 106.283; 90;

COD ID: 2016926

Formula: - C14 H19 N3 O3 -
Comments: Santos-Contreras, Rocio J.; Ramos-Organillo, Angel; García-Báez, Efrén V.; Padilla-Martínez, Itzia I.; Martínez-Martínez, Francisco J. The zwitterion of 4-nitro-2-{(E)-[2-(piperidin-1-yl)ethyl]iminomethyl}phenol Acta Crystallographica Section C 65(1) (2009) o8-o10
Space group: P 1 2/c 1
Cell volume: 1484.2
Cell parameters: 10.5688; 12.1887; 12.6816; 90; 114.696; 90;

COD ID: 2017035

Formula: - C9 H10 N4 O4 -
Comments: Gao, Xiao-Li; Lu, Li-Ping; Zhu, Miao-Li The crucial role of C—H···O and C=O···π interactions in the building of three-dimensional structures of dicarboxylic acid‒biimidazole compounds Acta Crystallographica Section C 65(4) (2009) o123-o127
Space group: P 1 2/c 1
Cell volume: 1042.2
Cell parameters: 15.663; 4.4319; 18.221; 90; 124.517; 90;

COD ID: 2017320

Formula: - C14 H10 Cd N2 O5 -
Comments: Wang, Ru-Guo; Qiao, Qian; Tang, Tian-Di Poly[[aqua(4,4'-diazenediyldibenzoato-κ^4^O,O':O'',O''')cadmium(II)]: a twofold interpenetrated three-dimensional coordination polymer of PtS topology Acta Crystallographica Section C 65(10) (2009) m388-m390
Space group: P 1 2/c 1
Cell volume: 667.56
Cell parameters: 14.8094; 6.4226; 7.0194; 90; 90.949; 90;

COD ID: 2018278

Formula: - C22 H28 Cl4 N8 O12 P4 -
Comments: Matczak-Jon, Ewa; Ślepokura, Katarzyna Conformations and resulting hydrogen-bonded networks of hydrogen {phosphono[(pyridin-1-ium-3-yl)amino]methyl}phosphonate and related 2-chloro and 6-chloro derivatives Acta Crystallographica Section C 67(11) (2011) o450-o456
Space group: P 1 2/c 1
Cell volume: 1589.2
Cell parameters: 8.555; 7.585; 24.56; 90; 94.32; 90;

COD ID: 2018335

Formula: - C7 H12 N4 O2 -
Comments: Rivera, Augusto; Quiroga, Diego; Ríos-Motta, Jaime; Fejfarová, Karla; Dušek, Michal The disordered molecular structure of (3aRS,7aRS)-1,3-dinitrosooctahydro-1H-benzimidazole Acta Crystallographica Section C 67(12) (2011) o505-o508
Space group: P 1 2/c 1
Cell volume: 878.2
Cell parameters: 10.8128; 8.4293; 10.9321; 90; 118.192; 90;

COD ID: 2018712

Formula: - H7 K5 O14 P4 -
Comments: Szafranowska, Barbara; Ślepokura, Katarzyna; Lis, Tadeusz Potassium salts of hypodiphosphoric acid Acta Crystallographica Section C 68(12) (2012) i71-i82
Space group: P 1 2/c 1
Cell volume: 807.3
Cell parameters: 10.208; 6.875; 11.769; 90; 102.2; 90;

COD ID: 2018756

Formula: - C14 H10 N2 O5 Zn -
Comments: Liu, Lei-Lei; Zhao, Feng Poly[aqua[μ~4~-3,3'-(diazenediyl)dibenzoato]zinc] Acta Crystallographica Section C 69(1) (2013) 29-32
Space group: P 1 2/c 1
Cell volume: 660.9
Cell parameters: 14.424; 6.3401; 7.234; 90; 92.51; 90;

COD ID: 2018794

Formula: - C10 H8 Cu I N4 -
Comments: Huang, Wenjiang; Zhang, Jinfang; Li, Jianghua; Zhang, Chi A twofold interwoven two-dimensional→two-dimensional (2-D→2-D) cluster‒organic network based on the [Cu~2~I~2~] cluster and the 4,4'-(diazenediyl)dipyridine ligand: poly[[μ~2~-4,4'-(diazenediyl)dipyridine]-μ~2~-iodido-copper(I)] Acta Crystallographica Section C 69(2) (2013) 123-126
Space group: P 1 2/c 1
Cell volume: 1193.6
Cell parameters: 9.7137; 8.0745; 15.396; 90; 98.73; 90;

COD ID: 2019108

Formula: - C19 H21 N3 O4 S -
Comments: Bambi-Nyanguile, Sylvie-Mireille; Mangwala Kimpende, Peter; Pirotte, Bernard; Van Meervelt, Luc N-tert-Butyl-N'-[5-cyano-2-(4-methylphenoxy)phenylsulfonyl]urea, a new TXA~2~ receptor antagonist Acta Crystallographica Section C 69(8) (2013) 901-903
Space group: P 1 2/c 1
Cell volume: 4188
Cell parameters: 10.6408; 15.8571; 24.8678; 90; 93.534; 90;

COD ID: 2019560

Formula: - C42 H30 N6 O34 S Sr7 -
Comments: Zhang, Wei; Qi, Shu-Guang; Feng, Yu-Quan A novel alkaline earth strontium(II) coordination polymer: poly[hexaaquatetrakis(μ~5~-pyridine-2,6-dicarboxylato)bis(μ~4~-pyridine-2,6-dicarboxylato)(μ~7~-sulfato)heptastrontium(II)] Acta Crystallographica Section C 70(6) (2014) 584-587
Space group: P 1 2/c 1
Cell volume: 2629
Cell parameters: 10.82; 10.69; 22.803; 90; 94.628; 90;

COD ID: 2019886

Formula: - C12 H11 Cl N2 O8 -
Comments: Wang, Bi-Qin; Yan, Hai-Biao; Huang, Zheng-Qing; Zhang, Yun-Hua; Sun, Jing Reversible phase transition of 2-carboxypyridinium perchlorate‒pyridinium-2-carboxylate (1/1) Acta Crystallographica Section C 71(4) (2015)
Space group: P 1 2/c 1
Cell volume: 726.8
Cell parameters: 10.252; 5.8362; 12.656; 90; 106.29; 90;

COD ID: 2019928