Search results

Formula: - C7 H16 N4 O2 -
Comments: Eda, Kazuo; Okazaki, Tadashi; Yamamura, Kimiaki; Hashimoto, Masao Three-dimensional supramolecular assembly having infinite two-dimensional interlocking networks built up only from simple and non-rigid organic molecules via hydrogen bonds. Crystal structures of α,ω-diureidoalkanes H~2~N(CO)NH–(CH~2~)n–NH(CO)NH~2~ with n=4 and 5 Journal of Molecular Structure 752(1-3) (2005) 93-97
Space group: P c c n
Cell volume: 990.8
Cell parameters: 8.2002; 13.084; 9.2354; 90; 90; 90;

COD ID: 1500005

Formula: - As3 Co2 H47 N12 O16 -
Comments: Ritu Bala; Raj Pal Sharma; Rajni Sharma; Juan M. Salas; Miguel Quirós; William T.A. Harrison Cationic cobaltammines as anion receptors: Synthesis, characterization an X-ray structure of bis-(hexaamminecobalt(III)) tris-(hydrogenarsenate) tetrahydrate Journal of Molecular Structure 828 (2007) 174-180
Space group: P c c n
Cell volume: 5242.9
Cell parameters: 27.4534; 13.1997; 14.468; 90; 90; 90;

COD ID: 1502236

Formula: - C30 H22 N4 O5 -
Comments: Deng, Hong-Ping; Wei, Yin; Shi, Min Highly regio- and diastereoselective construction of spirocyclopenteneoxindoles through phosphine-catalyzed [3 + 2] annulation of Morita-Baylis-Hillman carbonates with isatylidene malononitriles. Organic letters 13(13) (2011) 3348-3351
Space group: P c c n
Cell volume: 5272.2
Cell parameters: 9.165; 18.929; 30.39; 90; 90; 90;

COD ID: 1502321
CIF file	Formula: - C12 H18 O4 - Comments: Hao, Hong-Dong; Li, Yun; Han, Wei-Bo; Wu, Yikang A hydrogen peroxide based access to qinghaosu (artemisinin). Organic letters 13(16) (2011) 4212-4215 Space group: P c c n Cell volume: 2397.7 Cell parameters: 27.989; 9.0736; 9.4414; 90; 90; 90;

COD ID: 1502724

Formula: - C8 H10 N2 O -
Comments: Ośmiałowski, Borys; Kolehmainen, Erkki; Dobosz, Robert; Gawinecki, Ryszard; Kauppinen, Reijo; Valkonen, Arto; Koivukorpi, Juha; Rissanen, Kari Self-organization of 2-acylaminopyridines in the solid state and in solution. The journal of physical chemistry. A 114(38) (2010) 10421-10426
Space group: P c c n
Cell volume: 1570.4
Cell parameters: 12.7255; 15.1322; 8.1552; 90; 90; 90;

COD ID: 1502730

Formula: - C16 H20 N2 O -
Comments: Ośmiałowski, Borys; Kolehmainen, Erkki; Dobosz, Robert; Gawinecki, Ryszard; Kauppinen, Reijo; Valkonen, Arto; Koivukorpi, Juha; Rissanen, Kari Self-organization of 2-acylaminopyridines in the solid state and in solution. The journal of physical chemistry. A 114(38) (2010) 10421-10426
Space group: P c c n
Cell volume: 2704.41
Cell parameters: 9.8846; 27.5538; 9.9296; 90; 90; 90;

COD ID: 1502845
CIF file	Formula: - C16 H13 N O4 - Comments: Mondal, Mukulesh; Ibrahim, Ahmad A.; Wheeler, Kraig A.; Kerrigan, Nessan J. Phosphine-catalyzed asymmetric synthesis of beta-lactones from arylketoketenes and aromatic aldehydes. Organic letters 12(8) (2010) 1664-1667 Space group: P c c n Cell volume: 2682.44 Cell parameters: 24.6054; 7.0101; 15.5516; 90; 90; 90;

COD ID: 1502960

Formula: - C14 H20 Br2 S2 Si2 -
Comments: Getmanenko, Yulia A.; Tongwa, Paul; Timofeeva, Tatiana V.; Marder, Seth R. Base-catalyzed halogen dance reaction and oxidative coupling sequence as a convenient method for the preparation of dihalo-bisheteroarenes. Organic letters 12(9) (2010) 2136-2139
Space group: P c c n
Cell volume: 4008.9
Cell parameters: 8.0751; 17.198; 28.867; 90; 90; 90;

COD ID: 1503983

Formula: - C11 H20 N2 O2 -
Comments: Sharma, Rojita; Bulger, Paul G.; McNevin, Michael; Dormer, Peter G.; Ball, Richard G.; Streckfuss, Eric; Cuff, James F.; Yin, Jingjun; Chen, Cheng-yi A cascade approach to cyclic aminonitrones: reaction discovery, mechanism, and scope. Organic letters 11(15) (2009) 3194-3197
Space group: P c c n
Cell volume: 2470.77
Cell parameters: 20.5261; 12.69158; 9.48439; 90; 90; 90;

COD ID: 1505854
CIF file	Formula: - C76 H126 N4 Si6 - Comments: Miao, Shaobin; Smith, Mark D.; Bunz, Uwe H. F. Synthesis of a peralkynylated pyrazino[2,3-g]quinoxaline. Organic letters 8(4) (2006) 757-760 Space group: P c c n Cell volume: 8136.6 Cell parameters: 38.747; 13.9582; 15.0445; 90; 90; 90;

COD ID: 1506685
CIF file	Formula: - C12 H8 O4 - Comments: Gallant, Amanda J.; Yun, Michael; Sauer, Marc; Yeung, Charles S.; MacLachlan, Mark J. Tautomerization in naphthalenediimines: a keto-enamine Schiff base macrocycle. Organic letters 7(22) (2005) 4827-4830 Space group: P c c n Cell volume: 2768.6 Cell parameters: 10.126; 14.618; 18.704; 90; 90; 90;

COD ID: 1506728

Formula: - C27 H28 O Sn -
Comments: Dimopoulos, Paschalis; George, Jonathan; Tocher, Derek A.; Manaviazar, Soraya; Hale, Karl J. Mechanistic studies on the O-directed free-radical hydrostannation of disubstituted acetylenes with Ph3SnH and Et3B and on the iodination of allylically oxygenated alpha-triphenylstannylalkenes. Organic letters 7(24) (2005) 5377-5380
Space group: P c c n
Cell volume: 4524.2
Cell parameters: 15.4757; 40.118; 7.287; 90; 90; 90;

COD ID: 1506808
CIF file	Formula: - C12 H28 Cl Li O10 - Comments: Henderson, Wesley A.; Brooks, Neil R.; Brennessel, William W.; Young, Victor G. LiClO4Electrolyte Solvate Structures The Journal of Physical Chemistry A 108(1) (2004) 225 Space group: P c c n Cell volume: 5704.2 Cell parameters: 31.229; 12.075; 15.127; 90; 90; 90;

COD ID: 1506990
CIF file	Formula: - C38 H44 Cl10 S Sb - Comments: Yamazaki, Daisuke; Nishinaga, Tohru; Komatsu, Koichi Radical cation of dibenzothiophene fully annelated with bicyclo[2.2.2]octene units: X-ray crystal structure and electronic properties. Organic letters 6(23) (2004) 4179-4182 Space group: P c c n Cell volume: 4130 Cell parameters: 22.182; 9.474; 19.654; 90; 90; 90;

COD ID: 1507361
CIF file	Formula: - C42 H50 N6 O9 - Comments: Chong, Jonathan H.; Sauer, Marc; Patrick, Brian O.; MacLachlan, Mark J. Highly stable keto-enamine salicylideneanilines. Organic letters 5(21) (2003) 3823-3826 Space group: P c c n Cell volume: 9779.9 Cell parameters: 11.2522; 22.989; 37.8075; 90; 90; 90;

COD ID: 1507401
CIF file	Formula: - C27 H28 N2 O6 - Comments: Sello, Jason K.; Andreana, Peter R.; Lee, Daesung; Schreiber, Stuart L. Stereochemical control of skeletal diversity. Organic letters 5(22) (2003) 4125-4127 Space group: P c c n Cell volume: 4795.5 Cell parameters: 17.956; 20.546; 12.9986; 90; 90; 90;

COD ID: 1507907

Formula: - C27 H24 N4 O4 Zn -
Comments: Liu, Lu; Li, Xiaoli; Xu, Chunying; Han, Gang; Zhao, Ying; Hou, Hongwei; Fan, Yaoting Construction of six coordination networks based on a flexible bis(methylbenzimidazole) ligand and isomeric benzenedicarboxylates Inorganica Chimica Acta 391 (2012) 66-74
Space group: P c c n
Cell volume: 2360.2
Cell parameters: 17.237; 11.031; 12.413; 90; 90; 90;

COD ID: 1508111
CIF file	Formula: - C31 H50 Al N3 - Comments: Bonyhady, Simon J.; Collis, David; Frenking, Gernot; Holzmann, Nicole; Jones, Cameron; Stasch, Andreas Synthesis of a stable adduct of dialane(4) (Al2H4) via hydrogenation of a magnesium(I) dimer. Nature chemistry 2(10) (2010) 865-869 Space group: P c c n Cell volume: 6094 Cell parameters: 19.074; 21.504; 14.858; 90; 90; 90;

COD ID: 1508277

Formula: - C23 H15 I O -
Comments: Chen, Zhiyuan; Zeng, Mengjing; Yuan, Jianjun; Yang, Qin; Peng, Yiyuan Novel silver tetrafluoroborate catalyzed electrophilic cascade cyclization reaction: a facile approach to the synthesis of halo-substituted benzo[a]fluorenols. Organic letters 14(14) (2012) 3588-3591
Space group: P c c n
Cell volume: 3578.7
Cell parameters: 18.199; 26.703; 7.364; 90; 90; 90;

COD ID: 1508540

Formula: - C21 H26 F3 N O -
Comments: Markle, Todd F.; Tronic, Tristan A.; Dipasquale, Antonio G.; Kaminsky, Werner; Mayer, James M. Effect of basic site substituents on concerted proton-electron transfer in hydrogen-bonded pyridyl-phenols. The journal of physical chemistry. A 116(50) (2012) 12249-12259
Space group: P c c n
Cell volume: 7824.6
Cell parameters: 14.6043; 22.5308; 23.7796; 90; 90; 90;

COD ID: 1509677
CIF file	Formula: - Ag2 Nb P6 S25 Ti3 - Comments: Quarton, M.; Angenault, J.; Cieren, X.; Wallez, G. Two new thiophosphates with interlocked structures: Ag Ti2 (P S4)3 and Ag2 Nb Ti3 P6 S25 Journal of Solid State Chemistry 153 (2000) 55-65 Space group: P c c n Cell volume: 7256.24 Cell parameters: 22.609; 27.6939; 11.589; 90; 90; 90;

COD ID: 1510867
CIF file	Formula: - B28 Fe28 Gd8 - Comments: Givord, D.; Tenaud, P. Refinement of the crystal structure of R(1+e) Fe4 B4 compounds (R= Nd, Gd) Journal of the Less-Common Metals 123 (1986) 109-116 Space group: P c c n Cell volume: 1358.75 Cell parameters: 7.051; 7.051; 27.32999; 90; 90; 90;

COD ID: 1510967
CIF file	Formula: - B36 Fe36 Nd10 - Comments: Givord, D.; Tenaud, P. Refinement of the crystal structure of R(1+e) Fe4 B4 compounds (R= Nd, Gd) Journal of the Less-Common Metals 123 (1986) 109-116 Space group: P c c n Cell volume: 1776.35 Cell parameters: 7.117; 7.117; 35.06999; 90; 90; 90;

COD ID: 1511162
CIF file	Formula: - B Ga O4 Sr - Comments: He, M.; Liang, J.K.; Yang, Z.; Chen, X.L.; Chen, J.R. The crystal structure of alpha-(Sr Ga B O4) Crystal Research and Technology 39 (2004) 634-642 Space group: P c c n Cell volume: 794.009 Cell parameters: 15.3154; 8.9186; 5.813; 90; 90; 90;

COD ID: 1513024

Formula: - C19 H15 Cd N2 O3.5 -
Comments: Bing-Jun Zhang; Cui-Juan Wang; Guang-Mei Qiu; Shuai Huang; Xian-Li Zhou; Jie Weng; Yao-Yu Wang Polycarboxylate anions effect on the structures of a series of transition metal-based coordination polymers: Syntheses, crystal structures and bioactivities Inorganica Chimica Acta 397 (2013) 48-59
Space group: P c c n
Cell volume: 3818.7
Cell parameters: 14.1825; 17.9582; 14.9933; 90; 90; 90;

COD ID: 1513273

Formula: - C9 H15 N O4 -
Comments: Huang, Xiaonan; Du, Fusheng; Cheng, Jing; Dong, Yongquan; Liang, Dehai; Ji, Shouping; Lin, Shrong-Shi; Li, Zichen Acid-Sensitive Polymeric Micelles Based on Thermoresponsive Block Copolymers with Pendent Cyclic Orthoester Groups Macromolecules 42(3) (2009) 783
Space group: P c c n
Cell volume: 2147.3
Cell parameters: 24.132; 9.2945; 9.5736; 90; 90; 90;

COD ID: 1513451
CIF file	Formula: - C18 H15 N O7 - Comments: Jolibois, Alexandre E. R.; Lewis, William; Moody, Christopher J. Total synthesis of (±)-distomadines a and B. Organic letters 16(4) (2014) 1064-1067 Space group: P c c n Cell volume: 6385.3 Cell parameters: 30.1051; 30.0687; 7.05381; 90; 90; 90;

COD ID: 1514621
CIF file	Formula: - C60 H82 Mg2 N4 O4 - Comments: Lalrempuia, Ralte; Stasch, Andreas; Jones, Cameron The reductive disproportionation of CO2 using a magnesium(i) complex: analogies with low valent f-block chemistry Chemical Science 4(12) (2013) 4383 Space group: P c c n Cell volume: 5881.3 Cell parameters: 14.5246; 15.621; 25.9215; 90; 90; 90;

COD ID: 1515414

Formula: - C12 H18 N2 O -
Comments: Andrews, Natalie J.; Haynes, Cally J. E.; Light, Mark E.; Moore, Stephen J.; Tong, Christine C.; Davis, Jeffery T.; Harrell Jr., William A.; Gale, Philip A. Structurally simple lipid bilayer transport agents for chloride and bicarbonate Chemical Science 2(2) (2011) 256
Space group: P c c n
Cell volume: 4793.1
Cell parameters: 21.8777; 24.4332; 8.9667; 90; 90; 90;

COD ID: 1515681
CIF file	Formula: - C28 H29 N O2 S - Comments: Pérez-Galán, Patricia; Herrero-Gómez, Elena; Hog, Daniel T.; Martin, Nolwenn J. A.; Maseras, Feliu; Echavarren, Antonio M. Mechanism of the gold-catalyzed cyclopropanation of alkenes with 1,6-enynes Chemical Science 2(1) (2011) 141 Space group: P c c n Cell volume: 4738.4 Cell parameters: 34.3459; 11.0908; 12.4392; 90; 90; 90;

COD ID: 1515803

Formula: - C60 H72 Cl4 Sn2 -
Comments: Peng, Yang; Fischer, Roland C.; Merrill, W. Alexander; Fischer, Jelena; Pu, Lihung; Ellis, Bobby D.; Fettinger, James C.; Herber, Rolfe H.; Power, Philip P. Substituent effects in ditetrel alkyne analogues: multiple vs. single bonded isomers Chemical Science 1(4) (2010) 461
Space group: P c c n
Cell volume: 5525.2
Cell parameters: 20.3965; 15.7884; 17.1574; 90; 90; 90;

COD ID: 1515922

Formula: - C45 H30 F6 S2 -
Comments: Ohara, Hiroki; Morimoto, Masakazu; Irie, Masahiro Photochromism of dithienylethene single crystals having anthracene substituents. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 9(8) (2010) 1079-1081
Space group: P c c n
Cell volume: 3515.5
Cell parameters: 26.732; 8.0585; 16.3195; 90; 90; 90;

COD ID: 1516427

Formula: - C21 H21 N Si -
Comments: Han, Won-Sik; Son, Ho-Jin; Wee, Kyung-Ryang; Min, Kyoung-Tae; Kwon, Soonnam; Suh, Il-Hwan; Choi, Seung-Hoon; Jung, Dong Hyun; Kang, Sang Ook Silicon-Based Blue Phosphorescence Host Materials: Structure and Photophysical Property Relationship on Methyl/Phenylsilanes Adorned with 4-(N-Carbazolyl)phenyl Groups and Optimization of Their Electroluminescence by Peripheral 4-(N-Carbazolyl)phenyl Numbers The Journal of Physical Chemistry C 113(45) (2009) 19686
Space group: P c c n
Cell volume: 3739.3
Cell parameters: 19.1697; 21.281; 9.166; 90; 90; 90;

COD ID: 1516453

Formula: - C48 H50 N8 O5 -
Comments: Ono, Katsuhiko; Tsukamoto, Kenichi; Hosokawa, Ryohei; Kato, Masaki; Suganuma, Motohiro; Tomura, Masaaki; Sako, Katsuya; Taga, Keijiro; Saito, Katsuhiro A linear chain of water molecules accommodated in a macrocyclic nanotube channel. Nano letters 9(1) (2009) 122-125
Space group: P c c n
Cell volume: 4225
Cell parameters: 30.312; 20.567; 6.777; 90; 90; 90;

COD ID: 1516907
CIF file	Formula: - C12 H9 Cl2 O4 P - Comments: Payal Malik; Debashis Chakraborty Hydrogen phosphates: Self initiated organocatalysts for the controlled ring-opening polymerization of cyclic esters Inorganica Chimica Acta 400 (2013) 32-41 Space group: P c c n Cell volume: 1324.38 Cell parameters: 22.0545; 4.6788; 12.8346; 90; 90; 90;

COD ID: 1517427

Formula: - C12 H28 I Li O6 -
Comments: Vanhoutte, Gijs; Brooks, Neil R.; Schaltin, Stijn; Opperdoes, Bastiaan; Van Meervelt, Luc; Locquet, Jean-Pierre; Vereecken, Philippe M.; Fransaer, Jan; Binnemans, Koen Electrodeposition of Lithium from Lithium-Containing Solvate Ionic Liquids The Journal of Physical Chemistry C 118(35) (2014) 20152
Space group: P c c n
Cell volume: 1797.6
Cell parameters: 10.1824; 12.0243; 14.6817; 90; 90; 90;

COD ID: 1518140
CIF file	Formula: - C40 H58 Cu2 K N8 O52 Ru Si W11 - Comments: Shi, Dongying; He, Cheng; Qi, Bo; Chen, Cong; Niu, Jingyang; Duan, Chunying Merging of the photocatalysis and copper catalysis in metal‒organic frameworks for oxidative C‒C bond formation Chem. Sci. 6(2) (2015) 1035 Space group: P c c n Cell volume: 8835.3 Cell parameters: 17.8663; 22.1923; 22.2835; 90; 90; 90;

COD ID: 1518185

Formula: - F8 Ge H12 N4 -
Comments: Gantar, Darja; Golic, Ljubo; Leban, Ivan; Rahten, Anka Crystal structures of hydrazinium (2+) fluorometallates : crystal structures of hydrazinium (2+) difluoride hexafluorogermanate (IV) and hydrazinium (2+) pentafluoroantimonate (III) Revue de Chimie Minerale 23 (1986) 668-675
Space group: P c c n
Cell volume: 803.8
Cell parameters: 5.408; 13.721; 10.832; 90; 90; 90;

COD ID: 1519087
CIF file	Formula: - C15 H13 N O5 - Comments: Damsgaard, Anders; Hazell, Rita; Bols, Mikael Synthesis of Hydroxypiperidinecarboxylic Acids from Pyridinedicarboxylates Acta Chemica Scandinavica 53 (1999) 521-527 Space group: P c c n Cell volume: 3097.1 Cell parameters: 25.3676; 10.1589; 12.018; 90; 90; 90;

COD ID: 1519257
CIF file	Formula: - C10 H8 S2 - Comments: Murphy, Patrick J.; Light, Mark E.; Hursthouse, Michael B. C10H8S2 Crystal Structure Report Archive (2000) 733 Space group: P c c n Cell volume: 891.6 Cell parameters: 7.4172; 21.242; 5.6592; 90; 90; 90;

COD ID: 1519731
CIF file	Formula: - C97 H38 O5 - Comments: Smith, Paul D.; Coles, Simon J.; Hursthouse, Michael B. C24H29N5NiO3S2 Crystal Structure Report Archive (2004) 906 Space group: P c c n Cell volume: 11230.1 Cell parameters: 20.4346; 31.7982; 17.2829; 90; 90; 90;

COD ID: 1520209
CIF file	Formula: - C9 H14 N2 O4 - Comments: Callear, Samantha K.; Hursthouse, Michael B. 1,2-Dimethylimidazolium succinate Crystal Structure Report Archive (2008) 461 Space group: P c c n Cell volume: 2123.8 Cell parameters: 20.5769; 7.3521; 14.0383; 90; 90; 90;

COD ID: 1520352
CIF file	Formula: - C20 H28 B Cl3 F4 Ru2 - Comments: Fletcher, Nicholas C.; Horton, Peter N.; Hursthouse, Michael B. C20H28BCl3F4Ru2 Crystal Structure Report Archive (2009) 1250 Space group: P c c n Cell volume: 2389.4 Cell parameters: 10.7827; 13.1678; 16.8284; 90; 90; 90;

COD ID: 1529388
CIF file HKL data	Formula: - C3 H6 N2 O5 Pb0.5 - Comments: N.N. Golovnev; A.D. Vasiliev; M.S. Molokeev; G.V. Novikova; M.V. Sergeeva The synthesis of complex compounds of metals with b-alanine Vestnik KrasSU 2 (2004) 14-19 Space group: P c c n Cell volume: 1365 Cell parameters: 8.5528; 18.049; 8.8422; 90; 90; 90;

COD ID: 1529562
CIF file	Formula: - Cs3 Fe4 O20 P5 - Comments: Andrews-Allen, E.M.; Robinson, W.R. Crystal structures of a cesium iron(III) phosphate, Cs3 Fe4 (P O4)5, and a cesium iron(III) oxyphosphate, Cs7 Fe7 (P O4)8 O2 Journal of Solid State Chemistry 74 (1988) 88-97 Space group: P c c n Cell volume: 1926.67 Cell parameters: 9.838; 13.913; 14.076; 90; 90; 90;

COD ID: 1530200
CIF file	Formula: - Na2 O4 U - Comments: Kovba, L.M. The crystal structure of potassium and sodium monouranates Radiokhimiya 13 (1971) 309-311 Space group: P c c n Cell volume: 405.751 Cell parameters: 11.708; 5.805; 5.97; 90; 90; 90;

COD ID: 1530806
CIF file	Formula: - B12 F2 H12 K2 O - Comments: Solntsev, K.A.; Zukova, N.A.; Butman, L.A.; Kuznetsov, N.T. Structure and properties of (K2 B12 H10 F2) (H2 O) Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy 16 (1980) 1882-1884 Space group: P c c n Cell volume: 1224.07 Cell parameters: 7.992; 11.424; 13.407; 90; 90; 90;

COD ID: 1531436
CIF file	Formula: - Cu La2 O4.02 - Comments: Hidaka, M.; Tanaka, K.; Wakimoto, H.; Yoshimura, M.; Ohba, M.; Yamada, K. Structural phase transition and structural properties in oxygenated La2 Cu O4+y; y = 0.02 Phase Transition 74 (2001) 391-408 Space group: P c c n Cell volume: 380.569 Cell parameters: 5.3788; 5.385; 13.139; 90; 90; 90;

COD ID: 1532861
CIF file	Formula: - Ba0.086 Ca0.064 Cu La1.75 Nd0.1 O4 - Comments: McAllister, J.; Attfield, J.P. Cation size control of structure, structural fluctuations and superconductivity in L1.85 M0.15 Cu O4 Physical Review, Serie 3. B - Condensed Matter (18,1978-) 66 (2002) 014514-1-014514-10 Space group: P c c n Cell volume: 376.276 Cell parameters: 5.351; 5.3377; 13.174; 90; 90; 90;

COD ID: 1532862
CIF file	Formula: - Ba0.094 Ca0.056 Cu La1.7 Nd0.15 O4 - Comments: McAllister, J.; Attfield, J.P. Cation size control of structure, structural fluctuations and superconductivity in L1.85 M0.15 Cu O4 Physical Review, Serie 3. B - Condensed Matter (18,1978-) 66 (2002) 014514-1-014514-10 Space group: P c c n Cell volume: 376.137 Cell parameters: 5.3574; 5.3338; 13.163; 90; 90; 90;

COD ID: 1532863
CIF file	Formula: - Ba0.112 Cu La1.85 O4 Sr0.038 - Comments: McAllister, J.; Attfield, J.P. Cation size control of structure, structural fluctuations and superconductivity in L1.85 M0.15 Cu O4 Physical Review, Serie 3. B - Condensed Matter (18,1978-) 66 (2002) 014514-1-014514-10 Space group: P c c n Cell volume: 378.125 Cell parameters: 5.34916; 5.34237; 13.2317; 90; 90; 90;

COD ID: 1532864
CIF file	Formula: - Ba0.136 Cu La1.776 Nd0.074 O4 Sr0.014 - Comments: McAllister, J.; Attfield, J.P. Cation size control of structure, structural fluctuations and superconductivity in L1.85 M0.15 Cu O4 Physical Review, Serie 3. B - Condensed Matter (18,1978-) 66 (2002) 014514-1-014514-10 Space group: P c c n Cell volume: 378.122 Cell parameters: 5.35043; 5.34393; 13.2246; 90; 90; 90;

COD ID: 1532865
CIF file	Formula: - Ba0.15 Cu La1.736 Nd0.116 O4 - Comments: McAllister, J.; Attfield, J.P. Cation size control of structure, structural fluctuations and superconductivity in L1.85 M0.15 Cu O4 Physical Review, Serie 3. B - Condensed Matter (18,1978-) 66 (2002) 014514-1-014514-10 Space group: P c c n Cell volume: 378.117 Cell parameters: 5.3512; 5.34459; 13.2209; 90; 90; 90;

COD ID: 1533660
CIF file	Formula: - Ca2 Mn Ni O8 Pr2 - Comments: Han Duk-Kyun; Kim Sang-Hwan; Kwon Young-Uk; Lee Jeong-Soo; Kim Sung-Hyun; Hong Kun-Pyo Crystal structure and magnetism of layered Ln2 Ca2 Mn Ni O8 (Ln = Pr, Nd, Sm and Gd) compounds Journal of Solid State Chemistry 177 (2004) 1078-1086 Space group: P c c n Cell volume: 347.788 Cell parameters: 5.3625; 5.3663; 12.0857; 90; 90; 90;

COD ID: 1533663
CIF file	Formula: - Ca2 Mn Nd2 Ni O8 - Comments: Han Duk-Kyun; Kim Sang-Hwan; Kim Sung-Hyun; Hong Kun-Pyo; Kwon Young-Uk; Lee Jeong-Soo Crystal structure and magnetism of layered Ln2 Ca2 Mn Ni O8 (Ln = Pr, Nd, Sm and Gd) compounds Journal of Solid State Chemistry 177 (2004) 1078-1086 Space group: P c c n Cell volume: 346.018 Cell parameters: 5.3568; 5.3747; 12.0182; 90; 90; 90;

COD ID: 1533666
CIF file	Formula: - Ca2 Mn Ni O8 Sm2 - Comments: Han Duk-Kyun; Lee Jeong-Soo; Hong Kun-Pyo; Kim Sang-Hwan; Kim Sung-Hyun; Kwon Young-Uk Crystal structure and magnetism of layered Ln2 Ca2 Mn Ni O8 (Ln = Pr, Nd, Sm and Gd) compounds Journal of Solid State Chemistry 177 (2004) 1078-1086 Space group: P c c n Cell volume: 341.211 Cell parameters: 5.3673; 5.3405; 11.9038; 90; 90; 90;

COD ID: 1533669
CIF file	Formula: - Ca2 Gd2 Mn Ni O8 - Comments: Han Duk-Kyun; Kwon Young-Uk; Kim Sang-Hwan; Hong Kun-Pyo; Kim Sung-Hyun; Lee Jeong-Soo Crystal structure and magnetism of layered Ln2 Ca2 Mn Ni O8 (Ln = Pr, Nd, Sm and Gd) compounds Journal of Solid State Chemistry 177 (2004) 1078-1086 Space group: P c c n Cell volume: 338.384 Cell parameters: 5.3889; 5.3175; 11.8087; 90; 90; 90;

COD ID: 1533748
CIF file	Formula: - H6 K4 Mn O18 S4 - Comments: Troyanov, S.I.; Morozov, I.V.; Kemnitz, E. Bimetallic hydrogen sulfates K4 M(II) (H (S O4)2)2 (H2 O)2 (M(II)= Mn or Zn) Kristallografiya 47 (2002) 1031-1034 Space group: P c c n Cell volume: 1682.44 Cell parameters: 7.482; 20.908; 10.755; 90; 90; 90;

COD ID: 1533750
CIF file	Formula: - H6 K4 O18 S4 Zn - Comments: Troyanov, S.I.; Morozov, I.V.; Kemnitz, E. Bimetallic hydrogen sulfates K4 M(II) (H (S O4)2)2 (H2 O)2 (M(II)= Mn or Zn) Kristallografiya 47 (2002) 1031-1034 Space group: P c c n Cell volume: 1652.75 Cell parameters: 7.442; 20.981; 10.585; 90; 90; 90;

COD ID: 1534337
CIF file	Formula: - O3 Sb2 - Comments: Buerger, M. J. The crystal structure of valentinite American Mineralogist 21 (1936) 206-207 Space group: P c c n Cell volume: 332.263 Cell parameters: 12.46; 4.92; 5.42; 90; 90; 90;

COD ID: 1534987

Formula: - Cl6 Re Se4 -
Comments: Beck, J.; Desgroseilliers, A.; Mueller-Buschbaum, H.; Schlitt, K.J. Strukturbeziehungen zwischen Tetraselen(2+)-hexachlorometallaten: Synthese und Kristallstruktur von Se4 (Re Cl6) und Phasenumwandlung von Se4 (M Cl6) (M = Zr, Hf) Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 1145-1151
Space group: P c c n
Cell volume: 1171.24
Cell parameters: 10.915; 10.572; 10.15; 90; 90; 90;

COD ID: 1534991

Formula: - Cl6 Se4 Zr -
Comments: Beck, J.; Desgroseilliers, A.; Mueller-Buschbaum, H.; Schlitt, K.J. Strukturbeziehungen zwischen Tetraselen(2+)-hexachlorometallaten: Synthese und Kristallstruktur von Se4 (Re Cl6) und Phasenumwandlung von Se4 (M Cl6) (M = Zr, Hf) Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 1145-1151
Space group: P c c n
Cell volume: 1224.65
Cell parameters: 10.917; 10.803; 10.384; 90; 90; 90;

COD ID: 1535613
CIF file	Formula: - C4 K2 N4 Pt - Comments: Muehle, C.; Nuss, J.; Dinnebier, R.E.; Jansen, M. Ueber Kaliumtetracyanoplatinat(II), Kaliumtetracyanopalladat(II) und deren Monohydrate Zeitschrift fuer Anorganische und Allgemeine Chemie 630 (2004) 1462-1468 Space group: P c c n Cell volume: 874.829 Cell parameters: 13.7011; 9.0709; 7.0391; 90; 90; 90;

COD ID: 1535885
CIF file	Formula: - H14 N O13 Pr Se2 - Comments: Iskhakova, L.D. Crystal structure of N H4 Pr (Se O4)2 (H2 O)5 Kristallografiya 40 (1995) 631-634 Space group: P c c n Cell volume: 1211.54 Cell parameters: 7.019; 9.865; 17.497; 90; 90; 90;

COD ID: 1536234
CIF file	Formula: - Cl2 Cu O3 Te Zn - Comments: Johnsson, M.; Tornroos, K.W. Synthesis and crystal structure of the layered compound Cu Zn (Te O3) Cl2 Solid State Sciences 5 (2003) 263-266 Space group: P c c n Cell volume: 1179.8 Cell parameters: 10.1897; 15.5389; 7.4512; 90; 90; 90;

COD ID: 1536835
CIF file	Formula: - Br2.3 I8.7 Nb6 - Comments: Yoshiasa, A.; Borrmann, H.; Simon, A. Synthesis, structure and spin-crossover transition of the cluster compound Nb6I11-xBrx (0<= x<= 2.7) Zeitschrift fuer Anorganische und Allgemeine Chemie 620 (1994) 1329-1338 Space group: P c c n Cell volume: 2263.41 Cell parameters: 11.167; 15.091; 13.431; 90; 90; 90;

COD ID: 1536840
CIF file	Formula: - Br0.5 I10.5 Nb6 - Comments: Yoshiasa, A.; Simon, A.; Borrmann, H. Synthesis, structure and spin-crossover transition of the cluster compound Nb6I11-xBrx (0<= x<= 2.7) Zeitschrift fuer Anorganische und Allgemeine Chemie 620 (1994) 1329-1338 Space group: P c c n Cell volume: 2334.33 Cell parameters: 11.28; 15.302; 13.524; 90; 90; 90;

COD ID: 1539110
CIF file	Formula: - I11 Nb6 - Comments: Simon, A.; von Schnering, H.G.; Schaefer, H. Nb6 J11 - Eine Verbindung mit (Nb6 J8) - Gruppen Zeitschrift fuer Anorganische und Allgemeine Chemie 355 (1967) 295-310 Space group: P c c n Cell volume: 2345.21 Cell parameters: 11.299; 15.309; 13.558; 90; 90; 90;

COD ID: 1539806
CIF file	Formula: - B18 Fe18 Nd5 - Comments: Bocelli, G.; Calestani, G.; Leccabue, F. Structural investigation of incommensurate Nd(1+) epsilon Fe4B4 phase Solid State Communications 65 (1988) 1301-1305 Space group: P c c n Cell volume: 1785.39 Cell parameters: 7.13; 7.13; 35.12; 90; 90; 90;

COD ID: 1540188
CIF file	Formula: - C27 H37 Cu N2 S - Comments: Zhai, Junjie; Filatov, Alexander S.; Hillhouse, Gregory L.; Hopkins, Michael D. Synthesis, structure, and reactions of a copper‒sulfido cluster comprised of the parent Cu2S unit: {(NHC)Cu}2(μ-S) Chem. Sci. 7(1) (2016) 589 Space group: P c c n Cell volume: 2616.9 Cell parameters: 12.6538; 10.6947; 19.3375; 90; 90; 90;

COD ID: 1540648

Formula: - C81 H141 K2 La2 N4 O13 Si4 -
Comments: Kotyk, Christopher M.; Fieser, Megan E.; Palumbo, Chad T.; Ziller, Joseph W.; Darago, Lucy E.; Long, Jeffrey R.; Furche, Filipp; Evans, William J. Isolation of +2 rare earth metal ions with three anionic carbocyclic rings: bimetallic bis(cyclopentadienyl) reduced arene complexes of La2+and Ce2+are four electron reductants Chem. Sci. 6(12) (2015) 7267
Space group: P c c n
Cell volume: 18426.5
Cell parameters: 20.3261; 54.668; 16.5827; 90; 90; 90;

COD ID: 1540781

Formula: - Cu La2 O3.97 -
Comments: Yamada, K.; Kudo, E.; Endoh, Y.; Hidaka, Y.; Tsuda, K.; Oda, M.; Tanaka, M.; Asano, H.; Kokusho, K.; Murakami, T.; Izumi, F.; Suzuki, M. Determination of space group and refinement of structure parameters for La2 Cu O4-d crystals Japanese Journal of Applied Physics, Part 1 27 (1988) 1132-1137
Space group: P c c n
Cell volume: 380.265
Cell parameters: 5.3538; 5.4034; 13.1449; 90; 90; 90;

COD ID: 1541558
CIF file	Formula: - C13 H35 Cl2 O P Sn3 Zn - Comments: Fuhr, O.; Fenske, D. Die ungewoehnliche Umwandlung von P (Sn Me3)3 in P4 (Sn Me2)6 Zeitschrift fuer Anorganische und Allgemeine Chemie 630 (2004) 244-246 Space group: P c c n Cell volume: 5150.8 Cell parameters: 13.266; 29.89; 12.99; 90; 90; 90;

COD ID: 1542003
CIF file	Formula: - C5 H4 K3 N6 O3 V - Comments: Jagner, S.; Vannerberg, N.G. Note on the crystal structure of potassium Acta Chemica Scandinavica (1-27,1973-42,1988) 22 (1968) 3330-3331 Space group: P c c n Cell volume: 1314.14 Cell parameters: 15.6; 7.2; 11.7; 90; 90; 90;

COD ID: 1542236
CIF file	Formula: - Al B O4 Sr - Comments: Nagai, T.; Ihara, M. Crystal Structure of Di-Strontium Boro-Aluminate, 2(SrO)~2~⋅Al~2~O~3~⋅B~2~O~3~ Journal of the Ceramic Association, Japan 80(927) (1972) 432-437 Space group: P c c n Cell volume: 736.546 Cell parameters: 15.17; 8.86; 5.48; 90; 90; 90;

COD ID: 1542275
CIF file	Formula: - C21 H22 N4 O - Comments: Blackham, Emma E.; Knowles, Jonathan P.; Burgess, Jonathan; Booker-Milburn, Kevin I. Combining photochemistry and catalysis: rapid access to sp3‒ rich polyheterocycles from simple pyrroles Chem. Sci. 7(3) (2016) 2302 Space group: P c c n Cell volume: 3655.1 Cell parameters: 20.862; 10.4975; 16.69; 90; 90; 90;

COD ID: 1542659
CIF file	Formula: - C18 H9 O2 P S - Comments: Yamamura, Masaki; Hasegawa, Toru; Nabeshima, Tatsuya Synthesis of Phosphorus-Centered and Chalcogen-Bridged Concave Molecules: Modulation of Bowl Geometries and Packing Structures by Changing Bridging Atoms. Organic letters 18(4) (2016) 816-819 Space group: P c c n Cell volume: 2766.6 Cell parameters: 16.762; 22.071; 7.4782; 90; 90; 90;

COD ID: 1542896
CIF file	Formula: - C28 H17 N4 P S - Comments: Ren, Yi; Sezen, Melda; Guo, Fang; Jäkle, Frieder; Loo, Yueh-Lin [d]-Carbon‒carbon double bond engineering in diazaphosphepines: a pathway to modulate the chemical and electronic structures of heteropines Chem. Sci. 7(7) (2016) 4211 Space group: P c c n Cell volume: 4216 Cell parameters: 17.008; 32.243; 7.688; 90; 90; 90;

COD ID: 1543482

Formula: - C11 H8 Cl N O2 -
Comments: Tribak, Zineb; Kandri Rodi, Youssef; Haoudi, Amal; Essassi, El Mokhtar; Capet, Fréderic; Zouihri, Hafid 1-Allyl-5-chloroindoline-2,3-dione IUCrData 1(6) (2016) x160862
Space group: P c c n
Cell volume: 2059.23
Cell parameters: 31.2222; 7.9107; 8.3373; 90; 90; 90;

COD ID: 1544819

Formula: - C16 H14 Cl N O S -
Comments: Ravi, A. J.; Vinayaka, A. C.; Kumar, Shamantha; Sadashiva, M. P.; Devarajegowda, H. C. (2E)-3-Anilino-1-(2-chlorophenyl)-3-(methylsulfanyl)prop-2-en-1-one IUCrData 1(12) (2016) x161994
Space group: P c c n
Cell volume: 3047.6
Cell parameters: 15.9745; 25.7276; 7.4153; 90; 90; 90;

COD ID: 1546609

Formula: - C28 H25 B N3 O -
Comments: Chen, Na; Zhang, Wenjie; Chen, Shun; Wu, Qinghua; Yu, Changjiang; Wei, Yun; Xu, Yuekang; Hao, Erhong; Jiao, Lijuan Sterically Protected N2O-Type Benzopyrromethene Boron Complexes from Boronic Acids with Intense Red/Near-Infrared Fluorescence. Organic letters 19(8) (2017) 2026-2029
Space group: P c c n
Cell volume: 4555
Cell parameters: 18.38; 28.155; 8.802; 90; 90; 90;

COD ID: 1546911

Formula: - C72.75 H52.75 Ag B2 Cl5.25 F17 O2 P3 Pd3 S3 -
Comments: Maestri, Giovanni; WANG, Yanlan; Monfredini, Anna; Deyris, Pierre-Alexandre; Derat, Etienne; Malacria, Max; Blanchard, Florent All-Metal Aromatic Cationic Palladium Triangles Can Mimic Aromatic Donor Ligands towards Lewis Acidic Cations Chem. Sci. (2017)
Space group: P c c n
Cell volume: 20085.8
Cell parameters: 19.9665; 30.9093; 32.546; 90; 90; 90;

COD ID: 1547062
CIF file	Formula: - C16 H15 Br O4 - Comments: Lam, Shuk Mei; Wong, Wing-Tak; Chiu, Pauline An Approach to the Welwistatin Core via a Diazoketone Rearrangement-Ring Expansion Strategy. Organic letters 19(17) (2017) 4468-4471 Space group: P c c n Cell volume: 2932.4 Cell parameters: 15.6419; 23.9707; 7.8208; 90; 90; 90;

COD ID: 1547552
CIF file	Formula: - C14 H16 N2 O - Comments: Zhu, Nengbo; Wang, Ting; Ge, Liang; Li, Yajun; Zhang, Xinhao; Bao, Hongli γ-Amino Butyric Acid (GABA) Synthesis Enabled by Copper-Catalyzed Carboamination of Alkenes. Organic letters 19(18) (2017) 4718-4721 Space group: P c c n Cell volume: 2606.2 Cell parameters: 14.952; 18.354; 9.4968; 90; 90; 90;

COD ID: 1548156

Formula: - C32 H46 Cl Fe N2 O2 -
Comments: Duan, Ranlong; Hu, Chenyang; Li, Xiang; Pang, Xuan; Sun, Zhiqiang; Chen, Xuesi; Wang, Xianhong Air-Stable Salen‒Iron Complexes: Stereoselective Catalysts for Lactide and ε-Caprolactone Polymerization through in Situ Initiation Macromolecules 50(23) (2017) 9188
Space group: P c c n
Cell volume: 6581.2
Cell parameters: 15.5968; 38.1771; 11.0526; 90; 90; 90;

COD ID: 1548502
CIF file	Formula: - C40 H33 Au2 N2 O6.5 P2 - Comments: Lin Rong Er Gold rectangle, silver rings and helices - A study of self-assembly and molecular recognition of metallo-supramolecules Ph.D Thesis - NATIONAL UNIVERSITY OF SINGAPORE (2005) 1 Space group: P c c n Cell volume: 7712.1 Cell parameters: 21.247; 18.09; 20.065; 90; 90; 90;

COD ID: 1548992

Formula: - C24 H21 F6 N2 P -
Comments: Rosenberg, M.; Rostgaard, K. R.; Liao, Z.; Madsen, A Ø; Martinez, K. L.; Vosch, T.; Laursen, B. W. Design, synthesis, and time-gated cell imaging of carbon-bridged triangulenium dyes with long fluorescence lifetime and red emission. Chemical science 9(12) (2018) 3122-3130
Space group: P c c n
Cell volume: 4106.2
Cell parameters: 14.5591; 21.6499; 13.0273; 90; 90; 90;

COD ID: 1549066

Formula: - C15 H21 N3 O2 S -
Comments: Chaurasia, Rahul; Bharti, Akhilesh; Butcher, Ray J.; Wikaira, Jan L.; Bharty, Manoj K. 4-Cyclohexyl-1-(2-methoxybenzoyl)thiosemicarbazide with an unknown solvent IUCrData 3(3) (2018) x180383
Space group: P c c n
Cell volume: 3340.4
Cell parameters: 29.5823; 15.1971; 7.4303; 90; 90; 90;

COD ID: 1549081

Formula: - C57 H83 B2 Li O4 -
Comments: Kaese, Thomas; Trageser, Timo; Budy, Hendrik; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias A redox-active diborane platform performs C(sp3)-H activation and nucleophilic substitution reactions. Chemical science 9(15) (2018) 3881-3891
Space group: P c c n
Cell volume: 10871.9
Cell parameters: 21.5605; 26.1802; 19.2608; 90; 90; 90;

COD ID: 1549350

Formula: - C27 H37 Cl N2 O4 -
Comments: Minaker, Samuel A.; Wang, Ruiyao; Aquino, Manuel A. S. 1,3-Bis(2,6-diisopropylphenyl)imidazolium perchlorate IUCrData 3(4) (2018) x180516
Space group: P c c n
Cell volume: 2742.7
Cell parameters: 11.0729; 12.6284; 19.6141; 90; 90; 90;

COD ID: 1549935

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 c c n
Cell volume: 11697.9
Cell parameters: 19.0205; 20.3813; 30.1755; 90; 90; 90;

COD ID: 1550415

Formula: - C39 H32 Br2 N4 O -
Comments: Sindt, Ammon J.; DeHaven, Baillie A.; McEachern, David F.; Dissanayake, Madushanka M.; Smith, Mark D.; Vannucci, Aaron K.; Shimizu, Linda S. UV-irradiation of self-assembled triphenylamines affords persistent and regenerable radicals Chemical Science (2019)
Space group: P c c n
Cell volume: 3325.6
Cell parameters: 18.5184; 19.9443; 9.0043; 90; 90; 90;

COD ID: 1550937

Formula: - C32 H24 Br4 Ho N5 O5 -
Comments: Qin, Qi-Pin; Wang, Zhen-Feng; Tan, Ming-Xiong; Huang, Xiao-Ling; Zou, Hua-Hong; Zou, Bi-Qun; Shi, Bei-Bei; Zhang, Shu-Hua Complexes of lanthanides(iii) with mixed 2,2'-bipyridyl and 5,7-dibromo-8-quinolinoline chelating ligands as a new class of promising anti-cancer agents. Metallomics : integrated biometal science 11(5) (2019) 1005-1015
Space group: P c c n
Cell volume: 14208.5
Cell parameters: 29.5503; 29.9584; 16.0497; 90; 90; 90;

COD ID: 1550938

Formula: - C32 H24 Br4 Lu N5 O5 -
Comments: Qin, Qi-Pin; Wang, Zhen-Feng; Tan, Ming-Xiong; Huang, Xiao-Ling; Zou, Hua-Hong; Zou, Bi-Qun; Shi, Bei-Bei; Zhang, Shu-Hua Complexes of lanthanides(iii) with mixed 2,2'-bipyridyl and 5,7-dibromo-8-quinolinoline chelating ligands as a new class of promising anti-cancer agents. Metallomics : integrated biometal science 11(5) (2019) 1005-1015
Space group: P c c n
Cell volume: 14147
Cell parameters: 29.587; 29.91; 15.986; 90; 90; 90;

COD ID: 1551492

Formula: - C32 H22 F3 N O3 -
Comments: Labrador, Geraldine M.; Besnard, Céline; Bürgi, Thomas; Poblador-Bahamonde, Amalia I.; Bosson, Johann; Lacour, Jérôme Stereochemical significance of O to N atom interchanges within cationic helicenes: experimental and computational evidence of near racemization to remarkable enantiospecificity Chemical Science (2019)
Space group: P c c n
Cell volume: 4787.12
Cell parameters: 8.96089; 35.7856; 14.92847; 90; 90; 90;

COD ID: 1551873

Formula: - C18 H32 Br8 Mo6 N8 O4 S6 -
Comments: Kepenekian, Mikaël; Molard, Yann; Costuas, Karine; Lemoine, Pierric; Gautier, Régis; Ababou Girard, Soraya; Fabre, Bruno; Turban, Pascal; Cordier, Stéphane Red-NIR luminescence of Mo6 monolayered assembly directly anchored on Au(001) Materials Horizons 6(9) (2019) 1828
Space group: P c c n
Cell volume: 4848.5
Cell parameters: 21.7258; 13.1123; 17.0196; 90; 90; 90;

COD ID: 1552518
CIF file	Formula: - C27 H55 Mn N2 P4 Si - Comments: Price, Jeffrey S.; Emslie, David J. H. Interconversion and reactivity of manganese silyl, silylene, and silene complexes Chemical Science (2019) Space group: P c c n Cell volume: 6701.1 Cell parameters: 30.089; 12.8432; 17.3407; 90; 90; 90;

COD ID: 1552774
CIF file	Formula: - C8 H20 Cl N S2 - Comments: TOYAMA, Mari; CHAYAMA, Kenji Crystal Structure of 6-Aza-3,9-dithiaundecane Hydrochloride X-ray Structure Analysis Online 35 (2019) 55 Space group: P c c n Cell volume: 1264.94 Cell parameters: 25.0091; 5.39364; 9.37759; 90; 90; 90;

COD ID: 1553085
CIF file	Formula: - C29 H39 B N2 - Comments: Farrell, Jeffrey M.; Posaratnanathan, Roy T.; Stephan, Douglas W. A family of N-heterocyclic carbene-stabilized borenium ions for metal-free imine hydrogenation catalysis. Chemical science 6(3) (2015) 2010-2015 Space group: P c c n Cell volume: 5091 Cell parameters: 16.756; 19.073; 15.93; 90; 90; 90;

COD ID: 1553490

Formula: - C60 H44 N4 O4 Pd2 -
Comments: Naito, Masaya; Komiya, Naruyoshi; Naota, Takeshi Homochiral association of binuclear trans-bis(β-iminoaryloxy)palladium(ii) complexes doubly linked with m-xylylene spacers: drastic linker-dependence of the association chirality of chiral clothespin-shaped molecules Organic Chemistry Frontiers 3(10) (2016) 1286
Space group: P c c n
Cell volume: 16001.7
Cell parameters: 20.2007; 25.2676; 31.3498; 90; 90; 90;

COD ID: 1553505
CIF file	Formula: - C22 H25 N2 O4 P - Comments: Sun, Mengmeng; Sun, Suyan; Qiao, Huijie; Yang, Fan; Zhu, Yu; Kang, Jianxun; Wu, Yusheng; Wu, Yangjie Silver(i)-promoted C5‒H phosphonation of 8-aminoquinoline amides with H-phosphonates Organic Chemistry Frontiers 3(12) (2016) 1646 Space group: P c c n Cell volume: 4345.8 Cell parameters: 15.3031; 18.1046; 15.6855; 90; 90; 90;

COD ID: 1554386

Formula: - C48 H49 Cl2 N2 -
Comments: Li, Jia; Luo, Man; Sheng, Xingchao; Hua, Haiming; Yao, Weiwei; Pullarkat, Sumod A.; Xu, Li; Ma, Mengtao Unsymmetrical β-diketiminate magnesium(i) complexes: syntheses and application in catalytic hydroboration of alkyne, nitrile and carbonyl compounds Organic Chemistry Frontiers 5(24) (2018) 3538
Space group: P c c n
Cell volume: 4024.1
Cell parameters: 21.607; 13.2782; 14.0261; 90; 90; 90;

COD ID: 1554391

Formula: - C26 H35 Mg N2 -
Comments: Li, Jia; Luo, Man; Sheng, Xingchao; Hua, Haiming; Yao, Weiwei; Pullarkat, Sumod A.; Xu, Li; Ma, Mengtao Unsymmetrical β-diketiminate magnesium(i) complexes: syntheses and application in catalytic hydroboration of alkyne, nitrile and carbonyl compounds Organic Chemistry Frontiers 5(24) (2018) 3538
Space group: P c c n
Cell volume: 10024.9
Cell parameters: 17.7085; 33.2898; 17.0054; 90; 90; 90;

COD ID: 1555253

Formula: - C13 H8.64 O2 -
Comments: Bhunia, Mrinal; Sahoo, Sumeet Ranjan; Shaw, Bikash Kumar; Vaidya, Shefali; Pariyar, Anand; Vijaykumar, Gonela; Adhikari, Debashis; Mandal, Swadhin K. Storing redox equivalent in the phenalenyl backbone towards catalytic multi-electron reduction. Chemical science 10(31) (2019) 7433-7441
Space group: P c c n
Cell volume: 1850.7
Cell parameters: 7.379; 14.8543; 16.8845; 90; 90; 90;

COD ID: 1555381
CIF file	Formula: - C22 H20 N2 O5 - Comments: Chung, Tsai-Wen; Narhe, Bharat D.; Lin, Chun-Cheng; Sun, Chung-Ming Multicomponent Synthesis of Functionalized Tetrahydroacridinones: Insights into a Mechanistic Route. Organic letters 17(21) (2015) 5368-5371 Space group: P c c n Cell volume: 7371 Cell parameters: 22.182; 22.337; 14.877; 90; 90; 90;

COD ID: 1556395
CIF file	Formula: - C74 H72 O12 - Comments: Xia, Yu-Xiang; Xie, Tao; Han, Ying; Chen, Chuan-Feng Triptycene-derived calix[6]arene analogues: synthesis, structure and complexation with paraquat derivatives Organic Chemistry Frontiers 1(2) (2014) 140 Space group: P c c n Cell volume: 6163 Cell parameters: 17.548; 24.274; 14.468; 90; 90; 90;

COD ID: 1556499
CIF file	Formula: - C17 H25 N O - Comments: Gietz, T.; Boere, R.T. Backbone-Substituted beta-Ketoimines and Ketoiminate Clusters: Transoid Li2O2 Squares and D2-Symmetric Li4O4 Cubanes. Synthesis, Crystallography and DFT Calculations Inorganics 5 (2017) 30 Space group: P c c n Cell volume: 3139.1 Cell parameters: 12.3641; 16.3858; 15.4945; 90; 90; 90;

COD ID: 1556608

Formula: - C72 H60 Dy N3 O13 P4 -
Comments: Langley, S.K.; Vignesh, K.R.; Holton, K.; Benjamin, S.; Hix, G.B.; Phonsri, W.; Moubaraki, B.; Murray, K.S.; Rajaraman, G. Mononuclear Dysprosium(III) Complexes with Triphenylphosphine Oxide Ligands: Controlling the Coordination Environment and Magnetic Anisotropy Inorganics 6 (2018) 61
Space group: P c c n
Cell volume: 7035.9
Cell parameters: 16.0038; 16.5124; 26.6249; 90; 90; 90;

COD ID: 1556742
CIF file	Formula: - C22 H32 O2 S3 Si2 - Comments: Lumpi, Daniel; Kautny, Paul; Stöger, Berthold; Fröhlich, Johannes Crystal chemistry of layered structures formed by linear rigid silyl-capped molecules. IUCrJ 2(Pt 5) (2015) 584-600 Space group: P c c n Cell volume: 5484 Cell parameters: 33.63; 8.271; 19.717; 90; 90; 90;

COD ID: 1557054
CIF file	Formula: - C20 H14 I N - Comments: Martinez, Thibaut; Alahyen, Ismail; Lemière, Gilles; Mouriès-Mansuy, Virginie; Fensterbank, Louis Straightforward Access to 2-Iodoindolizines via Iodine-Mediated Cyclization of 2-Pyridylallenes Organic Process Research & Development (2020) Space group: P c c n Cell volume: 3261.2 Cell parameters: 16.5305; 18.7386; 10.5281; 90; 90; 90;

COD ID: 1557402

Formula: - C44 H42 B2 Br2 O2 -
Comments: Yuan, K.; Kahan, R. J.; Si, C.; Williams, A.; Kirschner, S.; Uzelac, M.; Zysman-Colman, E.; Ingleson, M. J. The synthesis of brominated-boron-doped PAHs by alkyne 1,1-bromoboration: mechanistic and functionalisation studies Chemical Science 11(12) (2020) 3258-3267
Space group: P c c n
Cell volume: 8229.7
Cell parameters: 42.071; 29.3977; 6.6541; 90; 90; 90;

COD ID: 1557555

Formula: - C13 H9 N3 O8 -
Comments: Butts, Craig P.; Eberson, Lennart; Hartshorn, Michael P.; Robinson, Ward T.; Wood, Bryan R. Photochemical Nitration by Tetranitromethane. Part XXX. Product Isolation and Identification in the Photochemical Reaction of Dibenzofuran Acta Chemica Scandinavica 50 (1996) 587-595
Space group: P c c n
Cell volume: 2693.5
Cell parameters: 9.386; 10.914; 26.294; 90; 90; 90;

COD ID: 1557606

Formula: - C40 H88 Cl4 N4 O4 P4 Pd2 U2 -
Comments: Feng, Genfeng; McCabe, Karl N.; Wang, Shuao; Maron, Laurent; Zhu, Congqing Construction of heterometallic clusters with multiple uranium‒metal bonds by using dianionic nitrogen‒phosphorus ligands Chemical Science 11(29) (2020) 7585-7592
Space group: P c c n
Cell volume: 5500.5
Cell parameters: 16.3226; 22.813; 14.7718; 90; 90; 90;

COD ID: 1557901
CIF file	Formula: - C42 H34 F9 N O - Comments: Okude, Ryo; Mori, Genki; Yagi, Akiko; Itami, Kenichiro Programmable synthesis of multiply arylated cubanes through C‒H metalation and arylation Chemical Science 11(29) (2020) 7672-7675 Space group: P c c n Cell volume: 7296.3 Cell parameters: 37.632; 14.8891; 13.0219; 90; 90; 90;

COD ID: 1557987

Formula: - C33 H48 I N4 O P Pt -
Comments: Deolka, Shubham; Rivada-Wheelaghan, Orestes; Aristizábal, Sandra L.; Fayzullin, Robert R.; Pal, Shrinwantu; Nozaki, Kyoko; Khaskin, Eugene; Khusnutdinova, Julia R. Metal‒metal cooperative bond activation by heterobimetallic alkyl, aryl, and acetylide PtII/CuI complexes Chemical Science 11(21) (2020) 5494-5502
Space group: P c c n
Cell volume: 7052.9
Cell parameters: 24.4749; 22.6183; 12.7406; 90; 90; 90;

COD ID: 1558720

Formula: - C22 H26 N2 O3 -
Comments: Hassan, Muhammad Murtaza; Israelian, Johan; Nawar, Nabanita; Ganda, Giovanni; Manaswiyoungkul, Pimyupa; Raouf, Yasir; Armstrong, David; Sedighi, Abootaleb; Olaoye, Olasunkanmi O.; Erdogan, Fettah; Cabral, Aaron D.; Angeles, Fabrizio; Altintas, Rabia; de Araujo, Elvin D.; Gunning, Patrick Thomas Characterization of Conformationally Constrained Benzanilide Scaffolds for Potent and Selective HDAC8 Targeting. Journal of medicinal chemistry (2020)
Space group: P c c n
Cell volume: 4455.89
Cell parameters: 21.4182; 22.3478; 9.3093; 90; 90; 90;

COD ID: 1559198

Formula: - C20 H14 O5 -
Comments: Fang, Zhuangjie; Jiang, Xiaodong; Zhang, Qingbo; Zhang, Liping; Zhang, Wenjun; Yang, Chunfang; Zhang, Haibo; Zhu, Yiguang; Zhang, Changsheng S-Bridged Thioether and Structure-Diversified Angucyclinone Derivatives from the South China Sea-Derived Micromonospora echinospora SCSIO 04089. Journal of natural products (2020)
Space group: P c c n
Cell volume: 3235.2
Cell parameters: 22.7722; 21.0367; 6.7533; 90; 90; 90;

COD ID: 1559726

Formula: - C248 H252 Mn24 N4 O140 -
Comments: Hu, Xiangquan; Feng, Sisi; Du, Jialei; Shao, Li; Lang, Jinxin; Zhang, Chen; Kelley, Steven P.; Lin, Jian; Dalgarno, Scott J.; Atwood, David A.; Atwood, Jerry L. Controlled hierarchical self-assembly of networked coordination nanocapsules via the use of molecular chaperones Chemical Science 11(46) (2020) 12547-12552
Space group: P c c n
Cell volume: 37605
Cell parameters: 37.471; 39.182; 25.613; 90; 90; 90;

COD ID: 1559970
CIF file	Formula: - C4 H6 O10 Pb3 S4 - Comments: Christensen, A. Norlund; Hazell, R. G. A Single-Crystal X-Ray Structure Determination of Pb3(S2O3)2(CH3COO)2 Acta Chemica Scandinavica 44 (1990) 1077-1079 Space group: P c c n Cell volume: 1423.2 Cell parameters: 17.53; 9.226; 8.8; 90; 90; 90;

COD ID: 1560744

Formula: - C14 H18 Ba Co O8 P2 -
Comments: Elias Jesu Packiam, D.; Vidyasagar, Kanamaluru Hydrothermal syntheses and characterization of phenyl- and benzyl-phosphonates and ethylene- and propylene-diphosphonates of cobalt(II), ACo(O3PR)2·xH2O and ACo(O3P-R-PO3)·2H2O (A = Ca, Sr, Ba; R = Ph, CH2Ph, -CH2CH2-, -CH2CH2CH2-) Journal of Solid State Chemistry 268 (2018) 115-122
Space group: P c c n
Cell volume: 3958.7
Cell parameters: 29.9034; 15.9541; 8.2978; 90; 90; 90;

COD ID: 1560791

Formula: - C46 H70 N4 O41 Zn4 -
Comments: Wen, Huiliang; Gong, Yunnan; Lai, Bowen; Liu, Zhifeng; Xiong, Zhiqiang; Liu, Chongbo Three microporous Zn coordination polymers constructed by 3,4,5-tris(carboxymethoxy)benzoic acid and 4,4′-bipyrdine: Structures, topologies, and luminescence Journal of Solid State Chemistry 266 (2018) 143-149
Space group: P c c n
Cell volume: 12139
Cell parameters: 36.709; 14.468; 22.856; 90; 90; 90;

COD ID: 1561084
CIF file	Formula: - C28 H28 Cd N5 O6 - Comments: Arıcı, Mürsel Construction, Structural Diversity and Properties of Five Coordination Polymers Based on 5-Nitroisophthalate and Bis(imidazole) Linkers Journal of Solid State Chemistry 262 (2018) 79-86 Space group: P c c n Cell volume: 5788.9 Cell parameters: 25.6123; 14.1294; 15.9965; 90; 90; 90;

COD ID: 1561264

Formula: - C36 H26 N6 O9 Zn2 -
Comments: Yuan, Fei; Yuan, Chun-Mei; Hu, Huai-Ming; Wang, Ting-Ting; Zhou, Chun-Sheng Structural diversity of a series of terpyridyl carboxylate coordination polymers: Luminescent sensor and magnetic properties Journal of Solid State Chemistry 258 (2018) 588-601
Space group: P c c n
Cell volume: 3391.4
Cell parameters: 8.21; 19.422; 21.269; 90; 90; 90;

COD ID: 1561329
CIF file	Formula: - C14 H10 O6 Pb - Comments: Singh, Suryabhan; Bhim, Anupam Water linked 3D coordination polymers: Syntheses, structures and applications Journal of Solid State Chemistry 244 (2016) 151-159 Space group: P c c n Cell volume: 2513.4 Cell parameters: 28.807; 7.5968; 11.4852; 90; 90; 90;

COD ID: 1561714
CIF file	Formula: - Fe H4 O6 S - Comments: Zhao, Long; Liu, Wei; Cao, Lixin; Su, Ge; Gao, Rongjie; Yang, Hongzhan A new member of ferrous sulfates, FeSO4·2H2O with PtS topology showing spin-canted long-range antiferromagnetic ordering Journal of Solid State Chemistry 231 (2015) 58-63 Space group: P c c n Cell volume: 440.237 Cell parameters: 6.316; 7.755; 8.988; 90; 90; 90;

COD ID: 1561936
CIF file	Formula: - C22 H22 N6 O13 Zn3 - Comments: Mu, Bao; Li, Qian; Lv, Lei; Yang, Dan-Dan; Wang, Qing; Huang, Ru-Dan Assembly and property research on seven 0D‒3D complexes derived from imidazole dicarboxylate and 1,2-bi(pyridin-4-yl)ethene Journal of Solid State Chemistry 226 (2015) 1-10 Space group: P c c n Cell volume: 2787.3 Cell parameters: 10.252; 13.228; 20.553; 90; 90; 90;

COD ID: 1562562

Formula: - C12 H14 Cl6 Cu0.78 In0.22 N2 -
Comments: Connor, Bridget; Smaha, Rebecca; Li, Jiayi; Gold-Parker, Aryeh; Heyer, Alexander; Toney, Michael F.; Lee, Young; Karunadasa, Hemamala I. Alloying a Single and a Double Perovskite: A Cu+/2+ Mixed-Valence Layered Halide Perovskite with Strong Optical Absorption Chemical Science (2021)
Space group: P c c n
Cell volume: 1730.38
Cell parameters: 7.4183; 32.1336; 7.259; 90; 90; 90;

COD ID: 1563725
CIF file	Formula: - C6 H18 Co N2 O6 P2 - Comments: Cheng, Chi-Chang; Chang, Wei-Kuo; Chiang, Ray-Kuang; Wang, Sue-Lein Synthesis and structural characterization of two cobalt phosphites: 1-D (H3NC6H4NH3)Co(HPO3)2 and 2-D (NH4)2Co2(HPo3)3 Journal of Solid State Chemistry 183(2) (2010) 304-309 Space group: P c c n Cell volume: 1281.79 Cell parameters: 17.0811; 8.5611; 8.7654; 90; 90; 90;

COD ID: 1564107

Formula: - C38 H30 F2 N6 O6 S3 Zn -
Comments: Doheny, Patrick W.; Hua, Carol; Chan, Bun; Tuna, Floriana; Collison, David; Kepert, Cameron J.; D'Alessandro, Deanna M Substituent effects on through-space intervalence charge transfer in cofacial metal-organic frameworks. Faraday discussions 231 (2021) 152-167
Space group: P c c n
Cell volume: 7569.97
Cell parameters: 26.0566; 18.5354; 15.6738; 90; 90; 90;

COD ID: 1564808

Formula: - C39 H32 Cl2 N4 O -
Comments: Hossain, Muhammad Saddam; Sindt, Ammon J.; Goodlett, Dustin W.; Shields, Dylan J.; O’Connor, Colin J.; Antevska, Aleksandra; Karakalos, Stavros G.; Smith, Mark D.; Garashchuk, Sophya; Do, Thanh D.; Gudmundsdottir, Anna D.; Shimizu, Linda S. Effects of Self-Assembly on the Photogeneration of Radical Cations in Halogenated Triphenylamines The Journal of Physical Chemistry C 125(36) (2021) 19991-20002
Space group: P c c n
Cell volume: 3296.6
Cell parameters: 18.4725; 19.8765; 8.9785; 90; 90; 90;

COD ID: 1565192

Formula: - C54 H52 Fe K N16 O16 -
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 c c n
Cell volume: 5917.6
Cell parameters: 22.3522; 14.581; 18.1566; 90; 90; 90;

COD ID: 1565245

Formula: - C28 H36 N6 Ni O4 -
Comments: Nagar, Suryakant; Chatterjee, Sucheta; Goswami, Dibakar; Cordes, David B.; Slawin, A.M.Z.; Chauhan, Rohit Singh; Prabhu, Pradnya Reactivity of nickel metal precursors towards amido linked N-heterocyclic carbenes and their catalytic studies for cross coupling reactions Inorganica Chimica Acta 504 (2020) 119446
Space group: P c c n
Cell volume: 2797.25
Cell parameters: 10.1795; 16.4812; 16.6731; 90; 90; 90;

COD ID: 1566163

Formula: - C608 H384 F60 N96 O64 Pd8 Sb10 -
Comments: Chen, Bin; Holstein, Julian J.; Platzek, André; Schneider, Laura; Wu, Kai; Clever, Guido H. Cooperativity of steric bulk and H-bonding in coordination sphere engineering: heteroleptic PdII cages and bowls by design Chemical Science (2022)
Space group: P c c n
Cell volume: 81961
Cell parameters: 41.972; 70.711; 27.616; 90; 90; 90;

COD ID: 1566417

Formula: - C154 H129 B30 Co3 N8 Nd O6 P6 -
Comments: Keener, Megan; Mattejat, Maxwell; Zheng, Shao-Liang; Wu, Guang; Hayton, Trevor W.; Ménard, Gabriel Selective electrochemical capture and release of uranyl from aqueous alkali, lanthanide, and actinide mixtures using redox-switchable carboranes Chemical Science (2022)
Space group: P c c n
Cell volume: 16297
Cell parameters: 19.004; 23.285; 36.829; 90; 90; 90;

COD ID: 1566825

Formula: - C26 H23 N S -
Comments: Zhou, Jun; Mao, Lijun; Wu, Meng-Xiang; Peng, Zhiyong; Yang, Yiming; Zhou, Manfei; Zhao, Xiao-Li; Shi, Xueliang; Yang, Hai-Bo Extended phenothiazines: synthesis, photophysical and redox properties, and efficient photocatalytic oxidative coupling of amines Chemical Science (2022)
Space group: P c c n
Cell volume: 4126.4
Cell parameters: 23.8497; 21.8615; 7.9142; 90; 90; 90;

COD ID: 1566849

Formula: - C50 H38 Mn N5 O3 -
Comments: Cao, Hongli; Wang, Junwen; Li, Jianfeng Nitrato(5,10,15,20-tetraphenylporphinato)manganese(III)–benzene–n-hexane (2/1/1) IUCrData 7(4) (2022) x220386
Space group: P c c n
Cell volume: 7789.4
Cell parameters: 20.1021; 21.5505; 17.9807; 90; 90; 90;

COD ID: 1567085

Formula: - C32 H72 Cr2 Li4 O4 -
Comments: Lo, Quintin; Pye, Dominic; Gesslbauer, Sami; Sim, Ying; García, Felipe; White, Andrew J. P.; Britovsek, George J. P. Single- and double-bridged PNP ligands in chromium-catalysed ethylene oligomerisation Catalysis Science & Technology 12(14) (2022) 4544-4551
Space group: P c c n
Cell volume: 3861.6
Cell parameters: 9.9307; 17.6625; 22.0161; 90; 90; 90;

COD ID: 1567089
CIF file	Formula: - C17 H23 B O3 - Comments: Cheng, Tairan; Liu, Boxiang; Wu, Rui; Zhu, Shifa Cu-Catalyzed Carboboration of Acetylene with Michael Acceptors Chemical Science (2022) Space group: P c c n Cell volume: 3287.8 Cell parameters: 21.7236; 13.8308; 10.9428; 90; 90; 90;

COD ID: 1568301

Formula: - C164 H130 N19 O15 Pd2 -
Comments: Bloch, Witold M.; Horiuchi, Shinnosuke; Holstein, Julian J.; Drechsler, Christoph; Wuttke, Axel; Hiller, Wolf; Mata, Ricardo A.; Clever, Guido H. Maximized axial helicity in a Pd2L4 cage: inverse guest size-dependent compression and mesocate isomerism. Chemical science 14(6) (2023) 1524-1531
Space group: P c c n
Cell volume: 15826
Cell parameters: 18.202; 29.004; 29.977; 90; 90; 90;

COD ID: 1568542
CIF file	Formula: - C8 H9 Br N2 O2 - Comments: Ji, Peng; Meng, Xiang; Chen, Jing; Gao, Feng; Xu, Hang; Wang, Wei Combining photoredox catalysis and hydrogen atom transfer for dearomative functionalization of electron rich heteroarenes. Chemical science 14(12) (2023) 3332-3337 Space group: P c c n Cell volume: 1866.6 Cell parameters: 13.263; 24.954; 5.6399; 90; 90; 90;

COD ID: 1568571

Formula: - C23 H33 O3.5 -
Comments: Chong, Chuanke; Chang, Le; Grimm, Isabelle; Zhang, Qunlong; Kuang, Yang; Wang, Bingjian; Kang, Jingyi; Liu, Wenhui; Baars, Julian; Guo, Yuanqiang; Schmalz, Hans-Günther; Lu, Zhaoyong Divergent total synthesis of the revised structures of marine anti-cancer meroterpenoids (+)-dysiherbols A-E. Chemical science 14(12) (2023) 3302-3310
Space group: P c c n
Cell volume: 3968.54
Cell parameters: 36.4809; 14.42217; 7.54283; 90; 90; 90;

COD ID: 1569425
CIF file	Formula: - C24 H30 N4 O3 - Comments: Yang, Zhaozheng; Esteve, Ferran; Antheaume, Cyril; Lehn, Jean-Marie Dynamic covalent self-assembly and self-sorting processes in the formation of imine-based macrocycles and macrobicyclic cages. Chemical science 14(24) (2023) 6631-6642 Space group: P c c n Cell volume: 2238.7 Cell parameters: 16.0157; 16.9055; 8.2684; 90; 90; 90;

COD ID: 1569665
CIF file	Formula: - C18 H16 N4 O - Comments: Borrel, Julien; Waser, Jerome Azido-alkynylation of alkenes through radical-polar crossover. Chemical science 14(35) (2023) 9452-9460 Space group: P c c n Cell volume: 3123.1 Cell parameters: 43.729; 9.4992; 7.5184; 90; 90; 90;

COD ID: 1570094
CIF file	Formula: - C47.25 H43.5 Cl2.5 F10 Ir N4 O4 - Comments: Tan, Yi Zhen; Wu, Xiangyang; Lu, Yunpeng; Chiba, Shunsuke; Yeow, Edwin K. L. Towards catalytic redox-active iridium polypyridyl complex by in situ photosubstitution Catalysis Science & Technology 14(1) (2024) 66-75 Space group: P c c n Cell volume: 10081.4 Cell parameters: 17.915; 22.4618; 25.0531; 90; 90; 90;

COD ID: 1570226

Formula: - Co4 Fe2 H92 Na14 O114 W18 -
Comments: Soriano-López, Joaquín; Steuber, Friedrich W.; Mulahmetović, Muhamed; Besora, Maria; Clemente-Juan, Juan Modesto; O'Doherty, Mariah; Zhu, Nian-Yong; Hill, Craig L.; Coronado, Eugenio; Poblet, Josep M.; Schmitt, Wolfgang Accelerating water oxidation - a mixed Co/Fe polyoxometalate with improved turnover characteristics. Chemical science 14(47) (2023) 13722-13733
Space group: P c c n
Cell volume: 9845
Cell parameters: 21.063; 26.187; 17.8488; 90; 90; 90;

COD ID: 1570727

Formula: - C14 H18 Br2 Ge I4 N2 -
Comments: Morteza Najarian, Amin; Dinic, Filip; Chen, Hao; Sabatini, Randy; Zheng, Chao; Lough, Alan J.; Maris, Thierry; Saidaminov, Makhsud I.; Garcia de Arquer, F. Pelayo; Voznyy, Oleksandr; Hoogland, Sjoerd; Sargent, Edward H. Homomeric Chains of intermolecular bonds scaffold octahedral germanium perovskites Nature 620 (2023) 328-335
Space group: P c c n
Cell volume: 2341.6
Cell parameters: 34.5436; 8.1885; 8.2783; 90; 90; 90;

COD ID: 1570730

Formula: - C14 H18 Cl2 Ge I4 N2 -
Comments: Morteza Najarian, Amin; Dinic, Filip; Chen, Hao; Sabatini, Randy; Zheng, Chao; Lough, Alan J.; Maris, Thierry; Saidaminov, Makhsud I.; Garcia de Arquer, F. Pelayo; Voznyy, Oleksandr; Hoogland, Sjoerd; Sargent, Edward H. Homomeric Chains of intermolecular bonds scaffold octahedral germanium perovskites Nature 620 (2023) 328-335
Space group: P c c n
Cell volume: 2303.58
Cell parameters: 34.1352; 8.1304; 8.3002; 90; 90; 90;

COD ID: 1571360

Formula: - C34.5 H38 Cl N9 O5 -
Comments: Li, Xing-Chi; Cheng, Ying; Wang, Xu-Dong; Tong, Shuo; Wang, Mei-Xiang De novo synthesis of inherently chiral heteracalix[4]aromatics from enantioselective macrocyclization enabled by chiral phosphoric acid-catalyzed intramolecular SNAr reaction. Chemical science 15(10) (2024) 3610-3615
Space group: P c c n
Cell volume: 7595.92
Cell parameters: 14.2497; 36.7753; 14.495; 90; 90; 90;

COD ID: 2000123

Formula: - C6 D4 I2 -
Comments: Alcobé, Xavier; Estop, Eugènia; Aliev, Abil E.; Harris, Kenneth D. M.; Rodríguez-Carvajal, Juan; Rius, Jordi Temperature-Dependent Structural Properties of p-Diiodobenzene: Neutron Diffraction and High-Resolution Solid State 13C NMR Investigations Journal of Solid State Chemistry 110(1) (1994) 20-27
Space group: P c c n
Cell volume: 784.779
Cell parameters: 17.092; 7.461; 6.154; 90; 90; 90;

COD ID: 2000270

Formula: - C8 H12 N2 O4 -
Comments: Główka, M. L. Structure of the 4-oxo-2-butenoic acid alkyl ester moiety. III. Structures of diethyl N,N'-(ethylenediamino)bis(4-oxo-2-butenoate) and propyl 4-oxo-4-ureido-2-butenoate Acta Crystallographica Section C 47(8) (1991) 1680-1683
Space group: P c c n
Cell volume: 3969.2
Cell parameters: 39.365; 10.147; 9.937; 90; 90; 90;

COD ID: 2000315

Formula: - C10 H10 Br2 Cu N8 O -
Comments: van Albada, G. A.; de Graaff, R. A. G.; Haasnoot, J. G.; Schild, J.; Reedijk, J. Structure of aquadibromobis(1,2,4-triazolo[1,5-a]pyrimidine-N3)copper(II), a one-dimensional alternating copper(II)^{···^} oxygen array Acta Crystallographica Section C 47(5) (1991) 946-949
Space group: P c c n
Cell volume: 1592.5
Cell parameters: 8.886; 15.025; 11.928; 90; 90; 90;

COD ID: 2000493
CIF file Original IUCr paper	Formula: - C32 H44 Br N3 O4 - Comments: Elding, M.; Larsson, A.-K.; Svensson, G.; Albertsson, J.; Eberson, L. Structure of a `hypervalent' linear bis(phthalimidato)bromate(I) complex Acta Crystallographica Section C 48(11) (1992) 2078-2080 Space group: P c c n Cell volume: 3375 Cell parameters: 12.288; 14.863; 18.479; 90; 90; 90;

COD ID: 2001155
CIF file Original IUCr paper	Formula: - C14 H22 Cl3 Co N6 O0.5 - Comments: Bonhôte, P.; Ferigo, M.; Stoeckli-Evans, H.; Marty, W. Structures of 2,6-bis(aminomethyl)pyridine (bamp) complexes of Fe^II^, Ni^II^, Zn^II^, Mn^II^, Co^III^ and Cu^II^ Acta Crystallographica Section C 49(12) (1993) 2102-2107 Space group: P c c n Cell volume: 4057.5 Cell parameters: 8.758; 26.749; 17.32; 90; 90; 90;

COD ID: 2002962

Formula: - C H8 F6 N4 Si -
Comments: Ross II, Charles R.; Bauer, M.R.; Nielson, R.M; Abrahams, S.C. Anhydrous ammonioguanidinium(2+) and dihydrated bis[aminoguanidinium(1+)] hexafluorosilicates: new co-products of preparing ferroelectric ammonioguanidinium(2+) hexafluorozirconate Acta Crystallographica Section B 55(2) (1999) 246-254
Space group: P c c n
Cell volume: 1387.82
Cell parameters: 10.4232; 17.6675; 7.5363; 90; 90; 90;

COD ID: 2003402

Formula: - C18 H46 Cl2 N2 O9 Si2 -
Comments: Rudert, R.; Schmaucks, G.; Zobel, D.; Strumpel, M. 3,3'-(1,1,3,3,-Tetramethyldisiloxane-1,3-diyl)bis(N-ethyl-N,N-dimethyl-1-propanaminium) Diperchlorate at 163 K and Room Temperature Acta Crystallographica Section C 51(4) (1995) 763-766
Space group: P c c n
Cell volume: 3050
Cell parameters: 16.154; 16.483; 11.454; 90; 90; 90;

COD ID: 2003403

Formula: - C18 H46 Cl2 N2 O9 Si2 -
Comments: Rudert, R.; Schmaucks, G.; Zobel, D.; Strumpel, M. 3,3'-(1,1,3,3,-Tetramethyldisiloxane-1,3-diyl)bis(N-ethyl-N,N-dimethyl-1-propanaminium) Diperchlorate at 163 K and Room Temperature Acta Crystallographica Section C 51(4) (1995) 763-766
Space group: P c c n
Cell volume: 2915
Cell parameters: 15.676; 16.433; 11.316; 90; 90; 90;

COD ID: 2003469
CIF file Original IUCr paper	Formula: - C17 H30 O Si2 - Comments: Pohl, E.; Herbst-Irmer, R.; Groth, U.; Eckenberg, P. <i>rac</i>-1,1,4-Trimethyl-5-trimethylsilyl-1,3,3a,4,6,7,8,9-octahydro-1-silanaphtho[1,2-<i>c</i>]furan at 153 K Acta Crystallographica Section C 51(5) (1995) 891-892 Space group: P c c n Cell volume: 3664.7 Cell parameters: 17.721; 19.714; 10.49; 90; 90; 90;

COD ID: 2003495
CIF file Original IUCr paper	Formula: - C23 H29 N O3 - Comments: Chiaroni, A.; Riche, C.; Dumas, F.; Potin, D.; d'Angelo, J. (±)-3-Methyl-1,1-diphenyl-2-butyl 3-Acetamidocrotonate and its Hydrogenation Product Acta Crystallographica Section C 51(5) (1995) 967-970 Space group: P c c n Cell volume: 4278 Cell parameters: 22.41; 20.76; 9.195; 90; 90; 90;

COD ID: 2003677
CIF file Original IUCr paper	Formula: - C18 H22 O2 - Comments: Yufit, D. S.; Struchkov, Yu. T.; Kozhushkov, S. I.; De Meijere, A. Ethyl Pentaspiro[2.0.2.0.0.2.0.2.0.1]tetradeca-14-ylideneacetate, C~18~H~22~O~2~ Acta Crystallographica Section C 51(7) (1995) 1325-1327 Space group: P c c n Cell volume: 3015 Cell parameters: 15.685; 25.364; 7.579; 90; 90; 90;

COD ID: 2004907
CIF file Original IUCr paper	Formula: - C12 H16 N2 O S - Comments: Ramnathan, A.; Sivakumar, K.; Srinivasan, N.; Janarthanan, N.; Ramadas, K.; Fun, H.-K. <i>N</i>-Phenyl-4-morpholinecarbothioamide and <i>N</i>-(2-Tolyl)-4-morpholinecarbothioamide Acta Crystallographica Section C 52(5) (1996) 1285-1288 Space group: P c c n Cell volume: 2388.8 Cell parameters: 40.201; 7.59; 7.829; 90; 90; 90;

COD ID: 2005614
CIF file Original IUCr paper	Formula: - C29 H22 O3 - Comments: Jedrzejas, M. J.; Rubin, M. D.; Baker, R. J.; Masnovi, J.; Towns, R. L. R. <i>cis</i>-4,5-Dihydroxy-2,3,4,5-tetraphenylcyclopent-2-enone Acta Crystallographica Section C 52(11) (1996) 2936-2939 Space group: P c c n Cell volume: 4340 Cell parameters: 24.856; 22.041; 7.921; 90; 90; 90;

COD ID: 2005811
CIF file Original IUCr paper	Formula: - C4 H12 Cd O4 P2 S4 - Comments: Ito, T.; Otake, M. Linear-Chain Structure of Bis(<i>O</i>,<i>O</i>'-dimethyldithiophosphato)cadmium(II) Acta Crystallographica Section C 52(12) (1996) 3024-3025 Space group: P c c n Cell volume: 1405.3 Cell parameters: 9.282; 17.837; 8.488; 90; 90; 90;

COD ID: 2006111
CIF file	Formula: - C7 H9 N O3 S - Comments: Sugaya, Nobutaka; Fujii, Isao; Hirayama, Noriaki; Arai, Hitoshi; Kasai, Masaji Structural Studies of Mitomycins. IX. Structure of 6-Demethyl-6-(phenylthiomethyl)mitomycin C Acta Crystallographica Section C 53 (1997) 610-612 Space group: P c c n Cell volume: 1597.1 Cell parameters: 14.637; 16.46; 6.629; 90; 90; 90;

COD ID: 2006826

Formula: - C17 H24 O4 -
Comments: Bolte, Michael; Scholtyssik, Maria A Tetragonal-Looking But Twinned Orthorhombic Structure Acta Crystallographica Section C 53(12) (1997) 1869-1871
Space group: P c c n
Cell volume: 3122.46
Cell parameters: 18.9237; 18.9167; 8.7226; 90; 90; 90;

COD ID: 2007196

Formula: - C30 H66 Cu4 I6 K2 N2 O12 -
Comments: Mague, Joel T. Luminescent Cu^I^ Clusters. Bis({tris[2-(2-methoxyethoxy)ethyl]amine}potassium) Hexaiodotetracuprate(I) Acta Crystallographica Section C 54(4) (1998) IUC9800010
Space group: P c c n
Cell volume: 5551.5
Cell parameters: 12.1045; 21.6675; 21.1669; 90; 90; 90;

COD ID: 2007675

Formula: - C7 H16 N2 O9 -
Comments: Barnes, John C.; Longhurst, Rayne W.; Weakley, Timothy J.R. Ethylenediammonium Bis(monohydrogen oxalate) Monohydrate and Two Modifications of Trimethylenediammonium Bis(monohydrogen oxalate) Monohydrate Acta Crystallographica Section C 54(9) (1998) 1347-1351
Space group: P c c n
Cell volume: 1228.6
Cell parameters: 14.6727; 7.3876; 11.3348; 90; 90; 90;

COD ID: 2007974
CIF file Original IUCr paper	Formula: - C6 H25 Mg N12 O10.5 S - Comments: Todor Todorov; Rosica Petrova; Krasimir Kossev; Josef Macíček; Olyana Angelova Magnesium Sulfate Hexaurea Hemihydrate Acta Crystallographica Section C 54(12) (1998) 1758-1760 Space group: P c c n Cell volume: 4391.9 Cell parameters: 15.316; 19.798; 14.484; 90; 90; 90;

COD ID: 2007996

Formula: - C19 H22 O -
Comments: Rainer Sjöholm; Reijo Sillanpää (3RS,4RS)-2-Methyl-3,4-diphenyl-5-hexen-3-ol Acta Crystallographica Section C 54(12) (1998) 1999-2001
Space group: P c c n
Cell volume: 3078
Cell parameters: 19.856; 21.45; 7.228; 90; 90; 90;

COD ID: 2008102
CIF file Original IUCr paper	Formula: - C44 H60 Cl4 Cu4 N4 O14 - Comments: Turpeinen, Urho; Hämälänen, Reijo; Mutikainen, Ilpo Aquatetrakis[(4-chlorobenzoato)(μ~3~-2-dimethylaminoethanolato)copper(II)] hydrate Acta Crystallographica Section C 55(1) (1999) 50-52 Space group: P c c n Cell volume: 10435 Cell parameters: 27.447; 20.311; 18.718; 90; 90; 90;

COD ID: 2009529
CIF file Original IUCr paper	Formula: - C17 H18 N4 O3 - Comments: Kolb, Vera M.; Robinson, Paul D.; Meyers, Cal Y. Intermolecular hydrogen-bonded structure of bis(4-methoxyphenylmethine)carbonohydrazide Acta Crystallographica Section C 50(3) (1994) 417-419 Space group: P c c n Cell volume: 1674 Cell parameters: 10.689; 17.448; 8.976; 90; 90; 90;

COD ID: 2009894
CIF file Original IUCr paper	Formula: - C54 H54 Fe N4 O10 P2 - Comments: Toupet, L.; Legrand, N.; Bondon, A.; Simonneaux, G. [<i>meso</i>-5,10,15,20-Tetrakis(4-methoxyphenyl)porphinato]bis(trimethyl phosphito)iron(II) Acta Crystallographica Section C 50(7) (1994) 1014-1016 Space group: P c c n Cell volume: 5077 Cell parameters: 21.122; 20.705; 11.61; 90; 90; 90;

COD ID: 2010326

Formula: - C22 H20 N2 O -
Comments: Millini, Roberto; Piero, Gasto Del; Allegrini, Pietro; Nodari, Nereo Chemical degradation of spiroindolinonaphthoxazines: 8,13,13-trimethyl-7a,8-dihydronaphtho[2,1-b]quinolino[3,2-e][1,4]oxazine, C~22~H~20~N~2~O Acta Crystallographica Section C 50(12) (1994) 2096-2098
Space group: P c c n
Cell volume: 3477.5
Cell parameters: 29.464; 13.861; 8.515; 90; 90; 90;

COD ID: 2010531

Formula: - C23 H28 O2 -
Comments: Ejsmont, Krzysztof; Kyzioł, Janusz; Nowakowska, Ewa; Zaleski, Jacek 4,4,4',4',7,7'-Hexamethyl-2,2'-spirobichroman Acta Crystallographica Section C 56(1) (2000) 93-94
Space group: P c c n
Cell volume: 1974.6
Cell parameters: 16.613; 10.557; 11.259; 90; 90; 90;

COD ID: 2010539

Formula: - C36 H26 O2 Se2 -
Comments: Senthil Kumar, V. S.; Nangia, Ashwini; 2,2'-Diselenobis(4,4-diphenylcyclohexa-2,5-dienone) 2,2'-Diselenobis(4,4-diphenylcyclohexa-2,5-dienone) Acta Crystallographica Section C 56(1) (2000) 123-124
Space group: P c c n
Cell volume: 2829.6
Cell parameters: 17.4144; 10.6767; 15.2187; 90; 90; 90;

COD ID: 2010907

Formula: - C28 H40 O8 -
Comments: Ellis, Dianne D.; Spek, Anthony L. 1,3:16,18-Bis(xylyl)-30-crown-8 Acta Crystallographica Section C 56(5) (2000) 596-597
Space group: P c c n
Cell volume: 2591.1
Cell parameters: 16.9096; 18.351; 8.35; 90; 90; 90;

COD ID: 2011317

Formula: - C27 H37 N -
Comments: Ramos Silva, M.; Matos Beja, A.; Paixao, J. A.; Alte da Veiga, L.; Sobral, A. J. F. N.; Rebanda, N. G. C. L.; Rocha Gonsalves, A. M. dA. C—H···π interactions in 9-(n-dodecylaminomethyl)anthracene Acta Crystallographica Section C 56(9) (2000) 1136-1138
Space group: P c c n
Cell volume: 4575
Cell parameters: 17.76; 32.336; 7.9664; 90; 90; 90;

COD ID: 2011401

Formula: - C22 H20 N2 O2 -
Comments: Scaccianoce, Laura; Feeder, Neil; Teat, Simon J.; Marseglia, Elisabeth A.; Grimsdale, Andrew C.; Holmes, Andrew B. A synchrotron diffraction study of two polymorphic forms of 2,5-bis[2-(4-methoxyphenyl)ethenyl]pyrazine Acta Crystallographica Section C 56(10) (2000) 1277-1279
Space group: P c c n
Cell volume: 1742.5
Cell parameters: 9.124; 26.061; 7.328; 90; 90; 90;

COD ID: 2012252

Formula: - C16 H20 Cl4 N4 Re -
Comments: Figgis, Brian N.; Sobolev, Alexandre N.; Schultz, Arthur J.; Reynolds, Philip A. Tetrachlorobis(N^1^-phenylacetamidino-κN^2^)rhenium(IV) at 11K by X-ray diffraction and at 20K by neutron diffraction Acta Crystallographica Section C 57(10) (2001) 1151-1153
Space group: P c c n
Cell volume: 1952.7
Cell parameters: 21.604; 7.268; 12.436; 90; 90; 90;

COD ID: 2012253

COD ID: 2013006

Formula: - C20 H36 O6 -
Comments: Kravtsov, Victor Ch.; Fonari, Marina S.; Zaworotko, Michael J.; Lipkowski, Janusz A new polymorph of cis‒transoid‒cis-dicyclohexano-18-crown-6 Acta Crystallographica Section C 58(11) (2002) o683-o684
Space group: P c c n
Cell volume: 2014.47
Cell parameters: 9.7563; 28.5733; 7.2263; 90; 90; 90;

COD ID: 2013243

Formula: - Cl2 O3 Te Zn2 -
Comments: Johnsson, Mats; Törnroos, Karl W. A synthetic zinc tellurium oxochloride, Zn~2~(TeO~3~)Cl~2~ Acta Crystallographica Section C 59(6) (2003) i53-i54
Space group: P c c n
Cell volume: 1238
Cell parameters: 10.4467; 15.4969; 7.6471; 90; 90; 90;

COD ID: 2013493

Formula: - C12 H20 Fe N6 O22 -
Comments: Kazumasa Honda; Hiroshi Yamawaki; Makoto Matsukawa; Midori Goto; Takehiro Matsunaga; Katsutoshi Aoki; Masatake Yoshida; Shuzo Fujiwara Hexaaquairon(II) dipicrate dihydrate Acta Crystallographica Section C 59(8) (2003) m319-m321
Space group: P c c n
Cell volume: 2370.6
Cell parameters: 25.248; 7.1136; 13.1993; 90; 90; 90;

COD ID: 2013581
CIF file Original IUCr paper	Formula: - C13 H16 N4 - Comments: Munro, Orde Q.; Camp, Greville L. Self-recognition in a flexible bis(pyrrole) Schiff base derivative: formation of a one-dimensional hydrogen-bonded polymer Acta Crystallographica Section C 59(12) (2003) o672-o675 Space group: P c c n Cell volume: 2553.8 Cell parameters: 15.469; 20.644; 7.997; 90; 90; 90;

COD ID: 2013663

Formula: - C17 H24 O4 -
Comments: Low, John N.; Cobo, Justo; Cruz, Silvia; Quiroga, Jairo; Glidewell, Christopher 2,2'-Methylenebis(3-hydroxy-5,5-dimethylcyclohex-2-en-1-one) Acta Crystallographica Section C 59(12) (2003) o666-o668
Space group: P c c n
Cell volume: 3108.38
Cell parameters: 18.8968; 18.8989; 8.7038; 90; 90; 90;

COD ID: 2013702

Formula: - C16 H10 Co3 O10 -
Comments: Yang, Shi-Yao; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng Polymeric dihydroxydiphthalatotricobalt(II) Acta Crystallographica Section C 59(11) (2003) m456-m458
Space group: P c c n
Cell volume: 3262.2
Cell parameters: 12.1121; 22.6847; 11.873; 90; 90; 90;

COD ID: 2014092

Formula: - C32 H48 Cl4 Cu2 N4 O2 -
Comments: You, Zhong-Lu; Zhu, Hai-Liang Bis{μ-2-[3-(cyclohexylammonio)propyliminomethyl]phenolato}bis[dichlorocopper(II)] Acta Crystallographica Section C 60(9) (2004) m445-m446
Space group: P c c n
Cell volume: 3576.7
Cell parameters: 15.487; 22.117; 10.442; 90; 90; 90;

COD ID: 2014308

Formula: - B2 O6 Pb Zn2 -
Comments: Chen, Xue-An; Zhao, Ying-Hua; Chang, Xin-An; Zhang, Li; Xue, Hai-Ping Lead zinc borate, PbZn~2~(BO~3~)~2~ Acta Crystallographica Section C 62(1) (2006) i11-i12
Space group: P c c n
Cell volume: 588.13
Cell parameters: 11.1709; 4.9674; 10.5987; 90; 90; 90;

COD ID: 2014311

Formula: - C6 H12 Ba O12 Zn -
Comments: Guo Ming-Lin; Guo Chen-Hu Poly[tetraaquadi-μ~4~-malonato-barium(II)zinc(II)] Acta Crystallographica Section C 62(1) (2006) m7-m9
Space group: P c c n
Cell volume: 1225.8
Cell parameters: 19.014; 6.8434; 9.4203; 90; 90; 90;

COD ID: 2015286
CIF file Original IUCr paper	Formula: - C36 H32 N4 O14 S4 - Comments: Kasyan, Oleg; Thondorf, Iris; Bolte, Michael; Kalchenko, Vitaly; Böhmer, Volker Unusual conformations of 1,3-dialkoxythiacalix[4]arenes in the solid state Acta Crystallographica Section C 62(5) (2006) o289-o294 Space group: P c c n Cell volume: 4007 Cell parameters: 8.876; 17.31; 26.0798; 90; 90; 90;

COD ID: 2015902

Formula: - C10 H8 O2 -
Comments: Marciniak, Bernard Naphthalene-1,7-diol Acta Crystallographica Section C 63(4) (2007) o252-o254
Space group: P c c n
Cell volume: 3182.6
Cell parameters: 21.423; 9.515; 15.613; 90; 90; 90;

COD ID: 2015983

Formula: - C8 H5 N O7 Sr -
Comments: Xiong, Li-Qin; Qi, Chuan-Min A novel two-dimensional layered framework built of strontium(II) with 4-nitrobenzene-1,3-dicarboxylic acid Acta Crystallographica Section C 63(6) (2007) m246-m248
Space group: P c c n
Cell volume: 1991.2
Cell parameters: 11.0883; 26.405; 6.801; 90; 90; 90;

COD ID: 2016002

Formula: - C14 H16 N2 O10 U -
Comments: Roberto Centore; Gaetano De Tommaso; Mauro Iuliano; Angela Tuzi An organouranium coordination polymer containing infinite metal oxide chains Acta Crystallographica Section C 63(6) (2007) m253-m255
Space group: P c c n
Cell volume: 1800.6
Cell parameters: 12.649; 16.258; 8.756; 90; 90; 90;

COD ID: 2016263

Formula: - C4 H20 Mn N4 O8 P2 -
Comments: Gaslain, Fabrice O. M.; Chippindale, Ann M. catena-Poly[bis(ethane-1,2-diammonium) [manganese(II)-di-μ-phosphato-κ^4^O:O']]: a one-dimensional manganese phosphate Acta Crystallographica Section C 63(11) (2007) m537-m540
Space group: P c c n
Cell volume: 1310.47
Cell parameters: 17.2363; 8.5726; 8.8689; 90; 90; 90;

COD ID: 2016317

Formula: - C18 H28 O8 -
Comments: Goverdhan Mehta; Saikat Sen; Kotapalli Pallavi Packing in three cyclooctitol acetates Acta Crystallographica Section C 63(12) (2007) o726-o728
Space group: P c c n
Cell volume: 3960
Cell parameters: 19.206; 26.611; 7.748; 90; 90; 90;

COD ID: 2016446

Formula: - C7 H8 I N O2 -
Comments: Dominik Cinčić; Branko Kaitner Hydrogen-bonding motifs in 3-carboxyanilinium bromide and iodide Acta Crystallographica Section C 64(2) (2008) o101-o104
Space group: P c c n
Cell volume: 1788.42
Cell parameters: 11.1815; 23.1582; 6.9066; 90; 90; 90;

COD ID: 2016857

Formula: - C16 H19 N O2 -
Comments: Lemmerer, Andreas The hydrogen-bonding patterns of 3-phenylpropylammonium benzoate and 3-phenylpropylammonium 3-iodobenzoate: generation of chiral crystals from achiral molecules Acta Crystallographica Section C 64(12) (2008) o626-o629
Space group: P c c n
Cell volume: 2816.2
Cell parameters: 16.2963; 23.3235; 7.4094; 90; 90; 90;

COD ID: 2016945

Formula: - C40 H40 Cu N4 O17 -
Comments: Koner, Rajesh; Goldberg, Israel Square-grid coordination networks of diaquabis(4,4'-bipyridyl)copper(II) crosslinked by hydrogen bonds through two monoanions of 1-benzofuran-2,3-dicarboxylic acid and five molecules of water Acta Crystallographica Section C 65(2) (2009) m62-m65
Space group: P c c n
Cell volume: 7962.49
Cell parameters: 15.847; 22.2874; 22.5446; 90; 90; 90;

COD ID: 2017372

Formula: - C10 H12 Br8 Cu N2 O2 -
Comments: Al-Far, Rawhi H.; Haddad, Salim F.; Ali, Basem Fares Three isomorphous 2,6-dibromopyridinium tetrabromidometallates: (C~5~H~4~Br~2~N)~2~[MBr~4~]·2H~2~O (M = Cu, Cd and Hg) Acta Crystallographica Section C 65(11) (2009) m451-m454
Space group: P c c n
Cell volume: 2178.4
Cell parameters: 10.2861; 13.4443; 15.7523; 90; 90; 90;

COD ID: 2017373

Formula: - C10 H12 Br8 Cd N2 O2 -
Comments: Al-Far, Rawhi H.; Haddad, Salim F.; Ali, Basem Fares Three isomorphous 2,6-dibromopyridinium tetrabromidometallates: (C~5~H~4~Br~2~N)~2~[MBr~4~]·2H~2~O (M = Cu, Cd and Hg) Acta Crystallographica Section C 65(11) (2009) m451-m454
Space group: P c c n
Cell volume: 2248.6
Cell parameters: 10.6168; 13.5358; 15.6473; 90; 90; 90;

COD ID: 2017374

Formula: - C10 H12 Br8 Hg N2 O2 -
Comments: Al-Far, Rawhi H.; Haddad, Salim F.; Ali, Basem Fares Three isomorphous 2,6-dibromopyridinium tetrabromidometallates: (C~5~H~4~Br~2~N)~2~[MBr~4~]·2H~2~O (M = Cu, Cd and Hg) Acta Crystallographica Section C 65(11) (2009) m451-m454
Space group: P c c n
Cell volume: 2243.7
Cell parameters: 10.6328; 13.5144; 15.6141; 90; 90; 90;

COD ID: 2018273

Formula: - C24 H12 F5 N O2 -
Comments: Schwarzer, Anke; Weber, Edwin Three new fluorinated N-phenyl-substituted pentacyclic ethanoanthracenedicarboximides Acta Crystallographica Section C 67(11) (2011) o457-o460
Space group: P c c n
Cell volume: 3710.2
Cell parameters: 18.259; 24.104; 8.4301; 90; 90; 90;

COD ID: 2018355

Formula: - C27 H36 Au Cl N2 -
Comments: Linden, Anthony; de Haro, Teresa; Nevado, Cristina [1,3-Bis(2,6-diisopropylphenyl)imidazol-2-ylidene]chloridogold(I) Acta Crystallographica Section C 68(1) (2012) m1-m3
Space group: P c c n
Cell volume: 2635.8
Cell parameters: 10.6655; 12.6641; 19.5145; 90; 90; 90;

COD ID: 2018421

Formula: - C H6 Cs2 O9 -
Comments: Medvedev, Alexander G.; Mikhaylov, Alexey A.; Churakov, Andrei V.; Prikhodchenko, Petr V.; Lev, Ovadia Ammonium and caesium carbonate peroxosolvates: supramolecular networks formed by hydrogen bonds Acta Crystallographica Section C 68(3) (2012) i20-i24
Space group: P c c n
Cell volume: 1786.3
Cell parameters: 17.82; 5.9357; 16.888; 90; 90; 90;

COD ID: 2019180
CIF file Original IUCr paper	Formula: - C39 H57 Al N6 - Comments: Mayo, Dennis H.; Peng, Yang; Zavalij, Peter; Bowen, Kit H.; Eichhorn, Bryan W. Aluminium(III) amidinates formed from reactions of `AlCl' with lithium amidinates Acta Crystallographica Section C 69(10) (2013) 1120-1123 Space group: P c c n Cell volume: 14998 Cell parameters: 31.286; 33.409; 14.3488; 90; 90; 90;

COD ID: 2019716

Formula: - C14 H10 O6 Pb -
Comments: Xu, Xiao-Juan A two-dimensional coordination polymer: poly[diaqua(μ~4~-4,4'-oxydibenzoato)(μ~2~-4,4'-oxydibenzoato)dilead(II)] Acta Crystallographica Section C 70(12) (2014)
Space group: P c c n
Cell volume: 2565.1
Cell parameters: 28.848; 7.6951; 11.5552; 90; 90; 90;

COD ID: 2019745

Formula: - C17 H14 Cl N5 O2 -
Comments: Bustos, Carlos; Alvarez-Thon, Luis; Oportus, Tania; Mesías-Salazar, Angela; Baggio, Ricardo On substituted pyrazole derivatives. II. (E)-1-(4-{[1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazol-4-yl]diazenyl}phenyl)ethanone and (E)-1-(4-chlorophenyl)-3,5-dimethyl-4-[2-(2-nitrophenyl)diazenyl]-1H-pyrazole Acta Crystallographica Section C 71(1) (2015)
Space group: P c c n
Cell volume: 3242
Cell parameters: 14.076; 30.549; 7.539; 90; 90; 90;

COD ID: 2019803

Formula: - C4 H5 N3 O -
Comments: Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Ravikumar, Krishnan The first polymorph in the family of nucleobases: a second form of cytosine Acta Crystallographica Section C 71(2) (2015)
Space group: P c c n
Cell volume: 2122.8
Cell parameters: 15.104; 15.1212; 9.2948; 90; 90; 90;

COD ID: 2019812

Formula: - C59 H57 Cl17 P4 Pt -
Comments: Anderson, Bradley G.; Hoyte, Sarah A.; Spencer, John L. Crystal structure of bis[1,3-bis(diphenylphosphanyl)propane-κ2P,P′]platinum(II) dichloride chloroform pentasolvate Acta Crystallographica Section E Crystallographic Communications 71(2) (2015) m37
Space group: P c c n
Cell volume: 6738
Cell parameters: 26.2042; 15.312; 16.793; 90; 90; 90;

COD ID: 2020116

Formula: - C16 H40 Cl14 N2 Si6 -
Comments: Tillmann, Jan; Lerner, Hans-Wolfram; Bolte, Michael A structural study of Si~6~-ring-containing [Si~6~Cl~14~]^2{-^} chlorosilicates Acta Crystallographica Section C 71(10) (2015)
Space group: P c c n
Cell volume: 3990.6
Cell parameters: 13.6864; 20.6309; 14.1328; 90; 90; 90;

COD ID: 2020451

Formula: - C23 H24 N4 -
Comments: Acosta Quintero, Lina M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher Six polycyclic pyrimidoazepine derivatives: syntheses, molecular structures and supramolecular assembly Acta Crystallographica Section C 72(4) (2016) 346-357
Space group: P c c n
Cell volume: 3686.8
Cell parameters: 15.083; 27.563; 8.8681; 90; 90; 90;

COD ID: 2020513

Formula: - C23 H27 N5 O5 -
Comments: Sanphui, Palash; Rajput, Lalit; Gopi, Shanmukha Prasad; Desiraju, Gautam R. New multi-component solid forms of anti-cancer drug Erlotinib: role of auxiliary interactions in determining a preferred conformation Acta Crystallographica Section B 72(3) (2016) 291-300
Space group: P c c n
Cell volume: 4561.5
Cell parameters: 21.6051; 23.7024; 8.9076; 90; 90; 90;

COD ID: 2020670

Formula: - C22 H28 N4 O4 -
Comments: Chia, Tze Shyang; Quah, Ching Kheng Monoclinic-to-orthorhombic phase transition of the hexamethylenetetramine‒2-methylbenzoic acid (1/2) cocrystal with temperature-dependent dynamic molecular disorder Acta Crystallographica Section C 72(12) (2016) 971-980
Space group: P c c n
Cell volume: 4169
Cell parameters: 31.0109; 9.3651; 14.3551; 90; 90; 90;

COD ID: 2020671

Formula: - C22 H28 N4 O4 -
Comments: Chia, Tze Shyang; Quah, Ching Kheng Monoclinic-to-orthorhombic phase transition of the hexamethylenetetramine‒2-methylbenzoic acid (1/2) cocrystal with temperature-dependent dynamic molecular disorder Acta Crystallographica Section C 72(12) (2016) 971-980
Space group: P c c n
Cell volume: 4169.3
Cell parameters: 31.0133; 9.3657; 14.354; 90; 90; 90;

COD ID: 2020672

Formula: - C22 H28 N4 O4 -
Comments: Chia, Tze Shyang; Quah, Ching Kheng Monoclinic-to-orthorhombic phase transition of the hexamethylenetetramine‒2-methylbenzoic acid (1/2) cocrystal with temperature-dependent dynamic molecular disorder Acta Crystallographica Section C 72(12) (2016) 971-980
Space group: P c c n
Cell volume: 4173.9
Cell parameters: 31.0259; 9.3706; 14.3567; 90; 90; 90;

COD ID: 2020673

Formula: - C22 H28 N4 O4 -
Comments: Chia, Tze Shyang; Quah, Ching Kheng Monoclinic-to-orthorhombic phase transition of the hexamethylenetetramine‒2-methylbenzoic acid (1/2) cocrystal with temperature-dependent dynamic molecular disorder Acta Crystallographica Section C 72(12) (2016) 971-980
Space group: P c c n
Cell volume: 4299.8
Cell parameters: 31.3604; 9.5095; 14.4182; 90; 90; 90;

COD ID: 2020843

Formula: - C24 H28 N6 O4 -
Comments: Martin, Kenneth L.; Breton, Gary W. Computational, ^1^H NMR, and X-ray structural studies on 1-arylurazole tetrazane dimers Acta Crystallographica Section C 73(9) (2017)
Space group: P c c n
Cell volume: 2410.5
Cell parameters: 9.1077; 13.5893; 19.476; 90; 90; 90;

COD ID: 2020894

Formula: - C3 H14 N10 O6 -
Comments: Buvaylo, Elena A.; Kokozay, Vladimir N.; Strutynska, Nataliia Yu.; Vassilyeva, Olga Yu.; Skelton, Brian W. Formaldehyde‒aminoguanidine condensation and aminoguanidine self-condensation products: syntheses, crystal structures and characterization Acta Crystallographica Section C 74(2) (2018)
Space group: P c c n
Cell volume: 2341.61
Cell parameters: 12.6989; 13.0236; 14.1585; 90; 90; 90;

COD ID: 2021021

Formula: - C10 H11 Cl N4 O4 -
Comments: Swinton Darious, Robert; Jasmine, Nithianantham Jeeva; Karthikeyan, Ammasai; Thomas Muthiah, Packianathan; Perdih, Franc Supramolecular architectures in cytosinium 6-chloronicotinate monohydrate and 5-bromo-6-methylisocytosinium hydrogen sulfate Acta Crystallographica Section C 74(3) (2018)
Space group: P c c n
Cell volume: 2437.5
Cell parameters: 19.5314; 12.7103; 9.8189; 90; 90; 90;

COD ID: 2021039

Formula: - C41 H41.5 N11 Ni O9.25 S -
Comments: Harvey, Miguel Angel; Suarez, Sebastián; Zolotarev, Pavel N.; Proserpio, Davide M.; Baggio, Ricardo Topological study of diverse hydrogen-bonded patterns found in a system of a nickel(II) complex and the sulfate anion Acta Crystallographica Section C 74(3) (2018)
Space group: P c c n
Cell volume: 9183
Cell parameters: 13.406; 24.365; 28.114; 90; 90; 90;

COD ID: 2021147

Formula: - C12 H15 N O5 -
Comments: Manin, Alex N.; Voronin, Alexander P.; Drozd, Ksenia V.; Churakov, Andrei V.; Perlovich, German L. Pharmaceutical salts of emoxypine with dicarboxylic acids Acta Crystallographica Section C 74(7) (2018)
Space group: P c c n
Cell volume: 2480.5
Cell parameters: 26.571; 6.9074; 13.5152; 90; 90; 90;

COD ID: 2021641

Formula: - C14 H22 N4 -
Comments: Qiao, Liang; Chen, Xiao-Gang; Gao, Ji-Xing; Ai, Yong Three new quinuclidine-based structures: second harmonic generation response for 1,2-bis(1-azoniabicyclo[2.2.2]octan-3-ylidene)hydrazine dichloride Acta Crystallographica Section C 75(6) (2019)
Space group: P c c n
Cell volume: 1301.08
Cell parameters: 19.7143; 6.6047; 9.9924; 90; 90; 90;

COD ID: 2021696

Formula: - C10 H9 N O4 -
Comments: Pogoda, Dorota; Janczak, Jan; Pawlak, Sylwia; Zaworotko, Michael; Videnova-Adrabinska, Veneta Tautomeric polymorphism of the neuroactive inhibitor kynurenic acid Acta Crystallographica Section C 75(6) (2019) 793-805
Space group: P c c n
Cell volume: 1771.69
Cell parameters: 13.9295; 17.8065; 7.1429; 90; 90; 90;

COD ID: 2022779

Formula: - C6 H8 Li2 N8 O12 -
Comments: Domasevitch, Kostiantyn V.; Senchyk, Ganna A.; Krautscheid, Harald catena-Poly[[bis(diaqualithium)]-μ4-3,3′,5,5′-tetranitro-4,4′-bipyrazole-1,1′-diido]: a new moisture-insensitive alkali-metal energetic salt with a well-defined network structure Acta Crystallographica Section E Crystallographic Communications 79(7) (2023)
Space group: P c c n
Cell volume: 1516.87
Cell parameters: 11.5094; 13.9839; 9.4247; 90; 90; 90;

COD ID: 2100532

Formula: - C12 H9 Cl N2 O -
Comments: Cuffini, Silvia; Glidewell, Christopher; Low, John N.; de Oliviera, Aline G.; de Souza, Marcus V. N.; Vasconcelos, Thatyana R. A.; Wardell, Solange M. S. V.; Wardell, James L. Nine N-aryl-2-chloronicotinamides: supramolecular structures in one, two and three dimensions Acta Crystallographica Section B 62(4) (2006) 651-665
Space group: P c c n
Cell volume: 2144
Cell parameters: 13.2296; 21.0744; 7.6898; 90; 90; 90;

COD ID: 2101992

Formula: - C40 H43 N3 O12 S3 -
Comments: Glidewell, Christopher; Ferguson, George; Gregson, Richard M.; Campana, Charles F. Supramolecular chemistry of amine‒phenol adducts; novel three-dimensional framework structures in adducts of bis(2-aminoethyl)amine with 4,4'-sulfonyldiphenol, 1,1,1-tris(4-hydroxyphenyl)ethane and 3,5-dihydroxybenzoic acid, and in the methanol-solvated adduct of tris(2-aminoethyl)amine with 4,4'-biphenol Acta Crystallographica Section B 56(1) (2000) 68-84
Space group: P c c n
Cell volume: 3998.5
Cell parameters: 13.7305; 14.9948; 19.4209; 90; 90; 90;

COD ID: 2102135

Formula: - C7 H10 O2 -
Comments: Katrusiak, A. Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals Acta Crystallographica Section B 56(5) (2000) 872-881
Space group: P c c n
Cell volume: 1276.7
Cell parameters: 13.427; 13.689; 6.946; 90; 90; 90;

COD ID: 2102136

Formula: - C7 H10 O2 -
Comments: Katrusiak, A. Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals Acta Crystallographica Section B 56(5) (2000) 872-881
Space group: P c c n
Cell volume: 1284.2
Cell parameters: 13.426; 13.69; 6.987; 90; 90; 90;

COD ID: 2102137

Formula: - C7 H10 O2 -
Comments: Katrusiak, A. Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals Acta Crystallographica Section B 56(5) (2000) 872-881
Space group: P c c n
Cell volume: 1300.3
Cell parameters: 13.466; 13.691; 7.053; 90; 90; 90;

COD ID: 2102138
CIF file Original IUCr paper	Formula: - C7 H10 O2 - Comments: Katrusiak, A. Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals Acta Crystallographica Section B 56(5) (2000) 872-881 Space group: P c c n Cell volume: 1300.3 Cell parameters: 13.466; 13.691; 7.053; 90; 90; 90;

COD ID: 2102139

Formula: - C7 H10 O2 -
Comments: Katrusiak, A. Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals Acta Crystallographica Section B 56(5) (2000) 872-881
Space group: P c c n
Cell volume: 1302.6
Cell parameters: 13.472; 13.692; 7.062; 90; 90; 90;

COD ID: 2102140

Formula: - C7 H10 O2 -
Comments: Katrusiak, A. Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals Acta Crystallographica Section B 56(5) (2000) 872-881
Space group: P c c n
Cell volume: 1307.8
Cell parameters: 13.472; 13.692; 7.09; 90; 90; 90;

COD ID: 2102141

Formula: - C7 H10 O2 -
Comments: Katrusiak, A. Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals Acta Crystallographica Section B 56(5) (2000) 872-881
Space group: P c c n
Cell volume: 1309.9
Cell parameters: 13.492; 13.692; 7.091; 90; 90; 90;

COD ID: 2102142

Formula: - C7 H10 O2 -
Comments: Katrusiak, A. Conformational transformation coupled with the order‒disorder phase transition in 2-methyl-1,3-cyclohexanedione crystals Acta Crystallographica Section B 56(5) (2000) 872-881
Space group: P c c n
Cell volume: 1311.2
Cell parameters: 13.498; 13.691; 7.095; 90; 90; 90;

COD ID: 2103184
CIF file Original IUCr paper	Formula: - C10 H21 Cl2 K2 N2 O8.5 Pd - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P c c n Cell volume: 1999.05 Cell parameters: 15.533; 16.225; 7.932; 90; 89.97; 90;

COD ID: 2103571

Formula: - C10 H8 O2 S4 -
Comments: Matsumoto, Shinya; Mizuguchi, Jin Structures of tetrathiabenzoquinone derivatives and the order‒disorder phase transition Acta Crystallographica Section B 57(1) (2001) 82-87
Space group: P c c n
Cell volume: 1095
Cell parameters: 9.401; 16.515; 7.053; 90; 90; 90;

COD ID: 2103572

Formula: - C12 H12 O2 S4 -
Comments: Matsumoto, Shinya; Mizuguchi, Jin Structures of tetrathiabenzoquinone derivatives and the order‒disorder phase transition Acta Crystallographica Section B 57(1) (2001) 82-87
Space group: P c c n
Cell volume: 1311.9
Cell parameters: 9.758; 16.846; 7.981; 90; 90; 90;

COD ID: 2103933

Formula: - C13 H24 N4 O4 -
Comments: Gardon, Manuel; Pinheiro, Carlos B.; Chapuis, Gervais Structural phases of hexamethylenetetramine‒pimelic acid (1/1): a unified description based on a stacking model Acta Crystallographica Section B 59(4) (2003) 527-536
Space group: P c c n
Cell volume: 3100.1
Cell parameters: 9.5005; 22.6599; 14.4004; 90; 90; 90;

COD ID: 2105475

Formula: - C28 H32 N4 O3 P2 -
Comments: Tarahhomi, Atekeh; Pourayoubi, Mehrdad; Golen, James A.; Zargaran, Poorya; Elahi, Behrouz; Rheingold, Arnold L.; Leyva Ramírez, Marco A.; Mancilla Percino, Teresa Hirshfeld surface analysis of new phosphoramidates Acta Crystallographica Section B 69(3) (2013) 260-270
Space group: P c c n
Cell volume: 2703.3
Cell parameters: 13.4363; 20.3532; 9.8851; 90; 90; 90;

COD ID: 2105691
CIF file Original IUCr paper	Formula: - C6 H10 K N O3 - Comments: Clegg, William; Tooke, Duncan M. Alkali metal complexes of 6-methyl-2-pyridone: simple formulae, but not so simple structures Acta Crystallographica Section B 69(6) (2013) 603-612 Space group: P c c n Cell volume: 1725.4 Cell parameters: 8.2804; 28.818; 7.2304; 90; 90; 90;

COD ID: 2105819

Formula: - C12 H8 Ag2 Fe N8 -
Comments: Rodríguez-Velamazán, José Alberto; Cañadillas-Delgado, Laura; Castro, Miguel; McIntyre, Garry J.; Real, José Antonio Temperature- and pressure-dependent structural study of {Fe(pmd)~2~[Ag(CN)~2~]~2~}~n~ spin-crossover compound by neutron Laue diffraction Acta Crystallographica Section B 70(3) (2014) 436-443
Space group: P c c n
Cell volume: 1604
Cell parameters: 14.895; 8.106; 13.285; 90; 90; 90;

COD ID: 2105820

Formula: - C12 H8 Ag2 Fe N8 -
Comments: Rodríguez-Velamazán, José Alberto; Cañadillas-Delgado, Laura; Castro, Miguel; McIntyre, Garry J.; Real, José Antonio Temperature- and pressure-dependent structural study of {Fe(pmd)~2~[Ag(CN)~2~]~2~}~n~ spin-crossover compound by neutron Laue diffraction Acta Crystallographica Section B 70(3) (2014) 436-443
Space group: P c c n
Cell volume: 1607.5
Cell parameters: 14.895; 8.122; 13.288; 90; 90; 90;

COD ID: 2105821

Formula: - C12 H8 Ag2 Fe N8 -
Comments: Rodríguez-Velamazán, José Alberto; Cañadillas-Delgado, Laura; Castro, Miguel; McIntyre, Garry J.; Real, José Antonio Temperature- and pressure-dependent structural study of {Fe(pmd)~2~[Ag(CN)~2~]~2~}~n~ spin-crossover compound by neutron Laue diffraction Acta Crystallographica Section B 70(3) (2014) 436-443
Space group: P c c n
Cell volume: 1770.9
Cell parameters: 15.782; 8.424; 13.32; 90; 90; 90;

COD ID: 2105822

Formula: - C12 H8 Ag2 Fe N8 -
Comments: Rodríguez-Velamazán, José Alberto; Cañadillas-Delgado, Laura; Castro, Miguel; McIntyre, Garry J.; Real, José Antonio Temperature- and pressure-dependent structural study of {Fe(pmd)~2~[Ag(CN)~2~]~2~}~n~ spin-crossover compound by neutron Laue diffraction Acta Crystallographica Section B 70(3) (2014) 436-443
Space group: P c c n
Cell volume: 1731
Cell parameters: 15.782; 8.235; 13.319; 90; 90; 90;

COD ID: 2105823

Formula: - C12 H8 Ag2 Fe N8 -
Comments: Rodríguez-Velamazán, José Alberto; Cañadillas-Delgado, Laura; Castro, Miguel; McIntyre, Garry J.; Real, José Antonio Temperature- and pressure-dependent structural study of {Fe(pmd)~2~[Ag(CN)~2~]~2~}~n~ spin-crossover compound by neutron Laue diffraction Acta Crystallographica Section B 70(3) (2014) 436-443
Space group: P c c n
Cell volume: 1738
Cell parameters: 15.78; 8.25; 13.35; 90; 90; 90;

COD ID: 2105824

Formula: - C12 H8 Ag2 Fe N8 -
Comments: Rodríguez-Velamazán, José Alberto; Cañadillas-Delgado, Laura; Castro, Miguel; McIntyre, Garry J.; Real, José Antonio Temperature- and pressure-dependent structural study of {Fe(pmd)~2~[Ag(CN)~2~]~2~}~n~ spin-crossover compound by neutron Laue diffraction Acta Crystallographica Section B 70(3) (2014) 436-443
Space group: P c c n
Cell volume: 1607.9
Cell parameters: 14.895; 8.125; 13.286; 90; 90; 90;

COD ID: 2105825

Formula: - C12 H8 Ag2 Fe N8 -
Comments: Rodríguez-Velamazán, José Alberto; Cañadillas-Delgado, Laura; Castro, Miguel; McIntyre, Garry J.; Real, José Antonio Temperature- and pressure-dependent structural study of {Fe(pmd)~2~[Ag(CN)~2~]~2~}~n~ spin-crossover compound by neutron Laue diffraction Acta Crystallographica Section B 70(3) (2014) 436-443
Space group: P c c n
Cell volume: 1731.8
Cell parameters: 15.782; 8.235; 13.325; 90; 90; 90;

COD ID: 2105826

Formula: - C12 H8 Ag2 Fe N8 -
Comments: Rodríguez-Velamazán, José Alberto; Cañadillas-Delgado, Laura; Castro, Miguel; McIntyre, Garry J.; Real, José Antonio Temperature- and pressure-dependent structural study of {Fe(pmd)~2~[Ag(CN)~2~]~2~}~n~ spin-crossover compound by neutron Laue diffraction Acta Crystallographica Section B 70(3) (2014) 436-443
Space group: P c c n
Cell volume: 1740.7
Cell parameters: 15.782; 8.262; 13.35; 90; 90; 90;

COD ID: 2105827

Formula: - C12 H8 Ag2 Fe N8 -
Comments: Rodríguez-Velamazán, José Alberto; Cañadillas-Delgado, Laura; Castro, Miguel; McIntyre, Garry J.; Real, José Antonio Temperature- and pressure-dependent structural study of {Fe(pmd)~2~[Ag(CN)~2~]~2~}~n~ spin-crossover compound by neutron Laue diffraction Acta Crystallographica Section B 70(3) (2014) 436-443
Space group: P c c n
Cell volume: 1727.8
Cell parameters: 15.782; 8.229; 13.304; 90; 90; 90;

COD ID: 2105828

Formula: - C12 H8 Ag2 Fe N8 -
Comments: Rodríguez-Velamazán, José Alberto; Cañadillas-Delgado, Laura; Castro, Miguel; McIntyre, Garry J.; Real, José Antonio Temperature- and pressure-dependent structural study of {Fe(pmd)~2~[Ag(CN)~2~]~2~}~n~ spin-crossover compound by neutron Laue diffraction Acta Crystallographica Section B 70(3) (2014) 436-443
Space group: P c c n
Cell volume: 1713.2
Cell parameters: 15.78; 8.2; 13.24; 90; 90; 90;

COD ID: 2105829

Formula: - C12 H8 Ag2 Fe N8 -
Comments: Rodríguez-Velamazán, José Alberto; Cañadillas-Delgado, Laura; Castro, Miguel; McIntyre, Garry J.; Real, José Antonio Temperature- and pressure-dependent structural study of {Fe(pmd)~2~[Ag(CN)~2~]~2~}~n~ spin-crossover compound by neutron Laue diffraction Acta Crystallographica Section B 70(3) (2014) 436-443
Space group: P c c n
Cell volume: 1726.2
Cell parameters: 15.782; 8.225; 13.298; 90; 90; 90;

COD ID: 2105830

Formula: - C12 H8 Ag2 Fe N8 -
Comments: Rodríguez-Velamazán, José Alberto; Cañadillas-Delgado, Laura; Castro, Miguel; McIntyre, Garry J.; Real, José Antonio Temperature- and pressure-dependent structural study of {Fe(pmd)~2~[Ag(CN)~2~]~2~}~n~ spin-crossover compound by neutron Laue diffraction Acta Crystallographica Section B 70(3) (2014) 436-443
Space group: P c c n
Cell volume: 1732.6
Cell parameters: 15.782; 8.242; 13.32; 90; 90; 90;

COD ID: 2105831

Formula: - C12 H8 Ag2 Fe N8 -
Comments: Rodríguez-Velamazán, José Alberto; Cañadillas-Delgado, Laura; Castro, Miguel; McIntyre, Garry J.; Real, José Antonio Temperature- and pressure-dependent structural study of {Fe(pmd)~2~[Ag(CN)~2~]~2~}~n~ spin-crossover compound by neutron Laue diffraction Acta Crystallographica Section B 70(3) (2014) 436-443
Space group: P c c n
Cell volume: 1731.5
Cell parameters: 15.782; 8.243; 13.31; 90; 90; 90;

COD ID: 2106198
CIF file	Formula: - H8 O8 P2 - Comments: Mootz, D.; Altenburg, H. Kristallstrukturen von Saeurehydraten und Oxoniumsalzen. VI. Dioxonium-dihydrogenhypophosphat, (H3 O)2 (H2 P2 O6) Acta Crystallographica B (24,1968-38,1982) 27 (1971) 1520-1523 Space group: P c c n Cell volume: 721.953 Cell parameters: 6.557; 11.634; 9.464; 90; 90; 90;

COD ID: 2106321
CIF file	Formula: - F8 H12 N4 Ti - Comments: Golic, L.; Kojic-Prodic, B.; Kaucic, V. Hydrazinium difluoride hexafluorotitanate(IV) Acta Crystallographica B (24,1968-38,1982) 36 (1980) 659-661 Space group: P c c n Cell volume: 814.542 Cell parameters: 5.481; 13.588; 10.937; 90; 90; 90;

COD ID: 2106418
CIF file	Formula: - Ba H4 O8 P2 - Comments: Prelesnik, B.; Herak, R.; Curic, M. The crystal structure of orthorhombic barium dihydrogenphosphate Acta Crystallographica B (24,1968-38,1982) 34 (1978) 76-78 Space group: P c c n Cell volume: 683.224 Cell parameters: 10.242; 7.793; 8.56; 90; 90; 90;

COD ID: 2108363
CIF file HKL data	Formula: - C17 H10 N2 - Comments: Kader, Thomas; Stöger, Berthold; Fröhlich, Johannes; Kautny, Paul The phase transitions of 4-aminopyridine-based indolocarbazoles: twinning, local- and pseudo-symmetry Acta Crystallographica Section B 75(1) (2019) 97-106 Space group: P c c n Cell volume: 1167.1 Cell parameters: 4.1239; 16.404; 17.252; 90; 90; 90;

COD ID: 2108368
CIF file HKL data	Formula: - C16 H9 N3 - Comments: Kader, Thomas; Stöger, Berthold; Fröhlich, Johannes; Kautny, Paul The phase transitions of 4-aminopyridine-based indolocarbazoles: twinning, local- and pseudo-symmetry Acta Crystallographica Section B 75(1) (2019) 97-106 Space group: P c c n Cell volume: 1152.3 Cell parameters: 4.0741; 16.416; 17.23; 90; 90; 90;

COD ID: 2200345

Formula: - C18 H16 Ag F6 P S2 -
Comments: Wen, Ming; Munakata, Megumu; Suenaga, Yusaku; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Yan, Sheng Gang A bent two-coordinate silver(I) complex with 2,2',3,3'-tetrahydro-4,4'-dithia-1,1'-binaphylidene Acta Crystallographica Section E 57(6) (2001) m246-m247
Space group: P c c n
Cell volume: 1829.3
Cell parameters: 7.109; 15.014; 17.139; 90; 90; 90;

COD ID: 2200448

Formula: - C12 H16 N2 O4 -
Comments: Moritani, Yoshimitsu; Takeda, Akihiko; Kashino, Setsuo Piperidinium p-nitrobenzoate Acta Crystallographica Section E 57(8) (2001) o707-o708
Space group: P c c n
Cell volume: 2554
Cell parameters: 8.949; 22.451; 12.712; 90; 90; 90;

COD ID: 2200866

Formula: - C20 H28 N4 O3 -
Comments: Cai, Yuepeng; Zhou, Zhongyuan; Qiu, Liqin; Kang, Beisheng; Chan, Albert S. C. 1,6-Bis(1-benzimidazolyl)hexane trihydrate Acta Crystallographica Section E 58(2) (2002) o167-o169
Space group: P c c n
Cell volume: 1988
Cell parameters: 14.4368; 16.426; 8.3834; 90; 90; 90;

COD ID: 2201032

Formula: - C6 H3 Br N2 O4 -
Comments: Kruszynski, Rafal; Czestkowski, Wojciech 1-Bromo-2,4-dinitrobenzene Acta Crystallographica Section E 58(5) (2002) o481-o483
Space group: P c c n
Cell volume: 1567.23
Cell parameters: 8.874; 11.2257; 15.7326; 90; 90; 90;

COD ID: 2201210

Formula: - C13 H24 O4 Sn -
Comments: Ramirez, Alejandro R.; Parvez, Masood; Ahmad, Viqar Uddin; Hussain, Javid; Hussain, Hidayat Polymeric di-n-butyl(glutarato)tin(IV) Acta Crystallographica Section E 58(6) (2002) m278-m280
Space group: P c c n
Cell volume: 1550.76
Cell parameters: 9.9698; 15.6977; 9.9088; 90; 90; 90;

COD ID: 2201989

Formula: - C37 H26 Cl2 N6 -
Comments: Vaduvescu, Simona; Potvin, Pierre G. 1,3-Bis(2,2':6',2''-terpyridin-4'-yl)benzene, a new dinucleating bis(tridentate) ligand, as its dichloromethane solvate Acta Crystallographica Section E 59(4) (2003) o483-o484
Space group: P c c n
Cell volume: 2992.9
Cell parameters: 8.0259; 18.111; 20.59; 90; 90; 90;

COD ID: 2202392

Formula: - C18 H18 O3 -
Comments: Tam, William; Lough, Alan J.; Jordan, Robert W. Ethyl 7-oxo-4-phenyltricyclo[4.2.1.0^2,5^]non-3-ene-3-carboxylate Acta Crystallographica Section E 59(11) (2003) o1685-o1686
Space group: P c c n
Cell volume: 2972.85
Cell parameters: 16.2196; 18.2187; 10.0604; 90; 90; 90;

COD ID: 2202672

Formula: - C23 H22 O -
Comments: Meyers, Cal Y.; McLean, Aaron W.; Robinson, Paul D. 9-(meta-tert-Butylphenyl)-9-fluorenol Acta Crystallographica Section E 59(7) (2003) o978-o980
Space group: P c c n
Cell volume: 3575
Cell parameters: 22.123; 24.203; 6.676; 90; 90; 90;

COD ID: 2202696

Formula: - C30 H20 F2 O4 -
Comments: Ohba, Shigeru; Yamamoto, Yohei; Tanaka, Koichi rac-3,3'-Bis(4-fluorophenyl)-3,3'-dihydroxy-2,3,2',3'-tetrahydro-[2,2']biindenyl-1,1'-dione Acta Crystallographica Section E 59(9) (2003) o1261-o1262
Space group: P c c n
Cell volume: 2280.6
Cell parameters: 8.303; 12.011; 22.868; 90; 90; 90;

COD ID: 2202839

Formula: - C8 H24 Cl2 O4 Ru S4 -
Comments: Srivastava, Radhey S.; Fronczek, Frank R. Orthorhombic cis-dichlorotetrakis(dimethyl sulfoxide)ruthenium(II) at 120K Acta Crystallographica Section E 59(7) (2003) m427-m428
Space group: P c c n
Cell volume: 3548.9
Cell parameters: 28.167; 10.817; 11.648; 90; 90; 90;

COD ID: 2202901

Formula: - C2 H5 N O -
Comments: Bats, Jan W.; Haberecht, Monika C.; Wagner, Matthias A new refinement of the orthorhombic polymorph of acetamide Acta Crystallographica Section E 59(10) (2003) o1483-o1485
Space group: P c c n
Cell volume: 1343
Cell parameters: 19.021; 7.5084; 9.4038; 90; 90; 90;

COD ID: 2203293

Formula: - C8 H12 Cl2 N4 O2 Zn -
Comments: Liang Shen; Mei Chao Li; Zhi Min Jin; Mao Lin Hu; Ri Cheng Xuan Bis(3-amino-5-methylisoxazole-κN)dichlorozinc(II) Acta Crystallographica Section E 60(3) (2004) m330-m331
Space group: P c c n
Cell volume: 2641.8
Cell parameters: 13.105; 14.054; 14.344; 90; 90; 90;

COD ID: 2203428

Formula: - C17 H18 N2 O4 -
Comments: Rabile, M. Mohamed; Huang, Huan; Ghosh, Dipesh; Van Horn, J. David; Powell, Doug R. 2,2'-(Propane-1,3-diimino)dibenzoic acid Acta Crystallographica Section E 60(4) (2004) o494-o496
Space group: P c c n
Cell volume: 1525.2
Cell parameters: 11.9318; 14.152; 9.0323; 90; 90; 90;

COD ID: 2203640

Formula: - C8 H26 F6 Ge N6 Ni -
Comments: Guo-Ming Wang; Yan-Qiong Sun; Guo-Yu Yang (Ethylenediamine-κ^2^N)(triethylenetetramine-κ^4^N)nickel hexafluorogermanate Acta Crystallographica Section E 60(5) (2004) m705-m707
Space group: P c c n
Cell volume: 1525.3
Cell parameters: 8.9029; 9.4731; 18.0856; 90; 90; 90;

COD ID: 2203834

Formula: - C40 H36 Cu I N2 P2 S -
Comments: Li, Dan; Luo, Ya-Fang; Wu, Tao; Ng, Seik Weng Iodo(1-methyl-2-mercaptoimidazole-κS)bis(triphenylphosphine-κP)copper(I) Acta Crystallographica Section E 60(6) (2004) m726-m727
Space group: P c c n
Cell volume: 7337.9
Cell parameters: 22.203; 17.877; 18.487; 90; 90; 90;

COD ID: 2203942

Formula: - C20 H18 Cl2 Cu N2 O2 -
Comments: Victor B. Rybakov; Tatiana A. Semenova; Lyudmila A. Aleshina; Vladimir P. Andreev; Yakov P. Nizhnik; Vladimir V. Chernyshev Dichlorobis(2-methylquinoline N-oxide-κO)copper(II) Acta Crystallographica Section E 60(7) (2004) m901-m903
Space group: P c c n
Cell volume: 1933.9
Cell parameters: 7.332; 15.185; 17.37; 90; 90; 90;

COD ID: 2204111

Formula: - C18 H22 Cl2 Cu N6 O4 -
Comments: Hai-Yan, Zhao; Xiao-Hang, Qiu; Pan-Wen, Shen Bis(2-aminoethyl-1H-benzimidazole-κN^3^)chlorocopper(II) perchlorate Acta Crystallographica Section E 60(8) (2004) m1111-m1113
Space group: P c c n
Cell volume: 2096.4
Cell parameters: 15.202; 11.241; 12.268; 90; 90; 90;

COD ID: 2204304

Formula: - C28 H18 N4 O13 Pb -
Comments: Hong-Ping Xiao; Ji-Xin Yuan Bis(hydrogen 5-nitroisophthalato)(1,10-phenanthroline)lead(II) monohydrate Acta Crystallographica Section E 60(10) (2004) m1501-m1503
Space group: P c c n
Cell volume: 2819.5
Cell parameters: 22.6083; 6.2232; 20.0394; 90; 90; 90;

COD ID: 2204599

Formula: - C24 H30 O8 -
Comments: Hu, Qingping; Ma, Mingliang; Shi, Jixian; Li, Yan; Zhou, Hongyu (2RS,3RS)-2,3-Dimethyl-1,4-bis(3,4,5-trimethoxyphenyl)butane-1,4-dione Acta Crystallographica Section E 60(11) (2004) o2101-o2102
Space group: P c c n
Cell volume: 2310.3
Cell parameters: 12.785; 14.47; 12.488; 90; 90; 90;

COD ID: 2204838

Formula: - C12 H8 I2 -
Comments: Britton, Doyle 4,4'-Diiodobiphenyl Acta Crystallographica Section E 61(1) (2005) o187-o188
Space group: P c c n
Cell volume: 1135.9
Cell parameters: 7.4189; 25.667; 5.9653; 90; 90; 90;

COD ID: 2205010

Formula: - C34 H16 N4 O4 -
Comments: Hino, Kazuyuki; Sato, Kazuyuki; Takahashi, Hiroo; Suzuki, Shigeru; Mizuguchi, Jin N,N'-Di-4-pyridylperylene-3,4:9,10-bis(dicarboximide) Acta Crystallographica Section E 61(2) (2005) o440-o441
Space group: P c c n
Cell volume: 2338.4
Cell parameters: 21.232; 15.89; 6.9311; 90; 90; 90;

COD ID: 2205013

Formula: - C30 H36 N8 Ni O13 -
Comments: Gao, Shan; Huo, Li-Hua; Zhao, Hui; Ng, Seik Weng Aquabis(3,5-dicarboxybenzoato-κO)bis(hexamethylenetetramine-κN)nickel(II) Acta Crystallographica Section E 61(2) (2005) m392-m393
Space group: P c c n
Cell volume: 3257.6
Cell parameters: 20.61; 12.246; 12.907; 90; 90; 90;

COD ID: 2205052

Formula: - C50 H70 Al2 O4 S4 -
Comments: Ma, Haiyan; Melillo, Gianluca; Oliva, Leone; Spaniol, Thomas P.; Okuda, Jun A dimeric alkyl complex supported by an O,S,S,O-tetradentate diphenolate ligand Acta Crystallographica Section E 61(2) (2005) m221-m222
Space group: P c c n
Cell volume: 5036.2
Cell parameters: 10.7048; 16.38; 28.722; 90; 90; 90;

COD ID: 2205333

Formula: - C11 H11 Cl N2 O -
Comments: G. Y. S. K. Swamy; K. Ravikumar; P. Narender; V. Jayathirtha Rao 2-[(2-Chloro-5-ethyl-3-pyridinyl)(hydroxy)methyl]acrylonitrile Acta Crystallographica Section E 61(3) (2005) o708-o709
Space group: P c c n
Cell volume: 2261
Cell parameters: 12.5354; 12.6028; 14.312; 90; 90; 90;

COD ID: 2206327

Formula: - C58 H42 N4 O6 -
Comments: Neng-Fang She; Hui-Zhen Guo; An-Xin Wu 1,3:4,6-Bis(1,4-diphenylethynyl-2,3-xylylene)tetrahydro-3a,6a-bis(ethoxycarbonyl)imidazo[4,5-d]imidazole-2,5(1H,3H)-dione, a molecular clip based on di(ethoxycarbonyl)glycoluril Acta Crystallographica Section E 61(7) (2005) o2003-o2004
Space group: P c c n
Cell volume: 4636.5
Cell parameters: 22.0779; 11.0552; 18.9962; 90; 90; 90;

COD ID: 2206610

Formula: - C18 H14 N6 S2 -
Comments: Ma, Zi-Chuan; Xian, Hong-Shi 2,3-Bis[(pyrimidin-2-ylsulfanyl)methyl]quinoxaline Acta Crystallographica Section E 61(8) (2005) o2746-o2747
Space group: P c c n
Cell volume: 3490.9
Cell parameters: 22.485; 12.361; 12.56; 90; 90; 90;

COD ID: 2206698

Formula: - C8 H24 Ca Mn O18 -
Comments: Qian Yang; Dong-Dong Lin; Duan-Jun Xu catena-Poly[[[diaquacalcium(II)]-μ-oxydiacetato-[tetraaquamanganese(II)]-μ-oxydiacetato] dihydrate] Acta Crystallographica Section E 61(9) (2005) m1826-m1828
Space group: P c c n
Cell volume: 1922.4
Cell parameters: 9.9572; 12.819; 15.061; 90; 90; 90;

COD ID: 2207208

Formula: - C26 H27 N O4 -
Comments: S. Selvanayagam; Jasmin Paul; D. Velmurugan; K. Ravikumar; R. Rathna Durga 3,3,6,6-Tetramethyl-9-(2-oxo-1,2-dihydroquinolin-3-yl)-1,2,3,4,5,6,7,8-octahydro-9H-xanthene-1,8-dione Acta Crystallographica Section E 61(11) (2005) o3701-o3703
Space group: P c c n
Cell volume: 4583.2
Cell parameters: 22.2713; 11.9162; 17.2698; 90; 90; 90;

COD ID: 2207350

Formula: - C8 H10 Ni O8 -
Comments: Sun, Xue-Hua catena-Poly[[triaquanickel(II)]-μ-5-hydroxyisophthalato] Acta Crystallographica Section E 61(11) (2005) m2256-m2258
Space group: P c c n
Cell volume: 2005.9
Cell parameters: 17.932; 7.4244; 15.067; 90; 90; 90;

COD ID: 2207607

Formula: - C7 H6 N2 -
Comments: Sławomir Krawczyk; Maria Gdaniec Polymorph β of 1H-benzimidazole Acta Crystallographica Section E 61(12) (2005) o4116-o4118
Space group: P c c n
Cell volume: 1234.4
Cell parameters: 9.7257; 16.6879; 7.6056; 90; 90; 90;

COD ID: 2208177

Formula: - C12 H20 Cl2 N4 Pt -
Comments: Gushchin, Pavel V.; Bokach, Nadezhda A.; Haukka, Matti; Dmitrieva, Elena S.; Kukushkin, Vadim Yu. trans-Dichlorobis(piperidine-1-carbonitrile)platinum(II) Acta Crystallographica Section E 62(2) (2006) m244-m246
Space group: P c c n
Cell volume: 1568.6
Cell parameters: 10.1398; 11.2092; 13.8008; 90; 90; 90;

COD ID: 2208379
CIF file Original IUCr paper	Formula: - C10 H16 O2 - Comments: Mo Aung Myint; Price, Jason R.; Eng Wui Tan Adamantane-1,2-diol Acta Crystallographica Section E 62(3) (2006) o1139-o1140 Space group: P c c n Cell volume: 1668.67 Cell parameters: 9.6159; 20.6781; 8.3921; 90; 90; 90;

COD ID: 2208492

Formula: - C16 H36 Cl4 Cu N4 Ni -
Comments: Wei, Zai-Shan; Yu, Guang-Ming (meso-5,7,7,12,14,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane)nickel(II) tetrachlorocuprate(II) Acta Crystallographica Section E 62(4) (2006) m693-m695
Space group: P c c n
Cell volume: 2343.2
Cell parameters: 9.7331; 14.943; 16.111; 90; 90; 90;

COD ID: 2208587
CIF file Original IUCr paper	Formula: - C8 H10 O8 Zn - Comments: Hong-Ping Xiao <i>catena</i>-Poly[[triaquazinc(II)]-μ-5-hydroxyisophthalato-κ^2^<i>O</i>:<i>O</i>'] Acta Crystallographica Section E 62(4) (2006) m731-m733 Space group: P c c n Cell volume: 2040 Cell parameters: 18.3046; 7.392; 15.0771; 90; 90; 90;

COD ID: 2208588
CIF file Original IUCr paper	Formula: - C8 H10 O8 Zn - Comments: Wang, Zuo-Wei; Li, Yi-Zhi; Cai, Ya; Zheng, He-Gen <i>catena</i>-Poly[[triaquazinc(II)]-μ-5-hydroxyisophthalato-κ^2^<i>O</i>:<i>O</i>'] Acta Crystallographica Section E 62(4) (2006) m734-m735 Space group: P c c n Cell volume: 2044.2 Cell parameters: 18.3236; 7.3975; 15.0812; 90; 90; 90;

COD ID: 2208616