Search results

Formula: - C12 H19 N4 O6.5 Zn -
Comments: Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron 23 (2004) 1505-1518
Space group: P b c n
Cell volume: 3223.2
Cell parameters: 20.4557; 10.4408; 15.0918; 90; 90; 90;

COD ID: 1100211

Formula: - C12 H33 I N P Si2 -
Comments: Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K. Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^ Zeitschrift für Anorganische und Allgemeine Chemie 626(3) (2000) 775-783
Space group: P b c n
Cell volume: 3935.4
Cell parameters: 25.54; 13.223; 11.653; 90; 90; 90;

COD ID: 1100256

Formula: - C108 H198 K4 N4 O2 P6 -
Comments: Gröb, Thorsten; Chitsaz, Soheila; Harms, Klaus; Dehnicke, Kurt Phosphaniminate von Alkalimetallen: Die Kristallstrukturen von [KNPCy~3~]~4~, [KNPCy~3~]~4~·2OPCy~3~, [CsNPCy~3~]~4~·4OPCy~3~ und [Li~4~(NPPh~3~)(OSiMe~2~NPPh~3~)~3~(DME)] Zeitschrift fuer Anorganische und Allgemeine Chemie 628(2) (2002) 473-479
Space group: P b c n
Cell volume: 11417.7
Cell parameters: 29.4359; 20.482; 18.9377; 90; 90; 90;

COD ID: 1100371

Formula: - C40 H64 Li2 N2 O13 S2 -
Comments: Boche, Gernot; Boie, Christiane; Bosold, Ferdinand; Harms, Klaus; Marsch, Michael [(N-Lithio-N-mesitylsulfonyloxy-tert-butylcarbamate)~2~·(thf)~3~]: Crystal Structure of a Nitrenoid Angewandte Chemie, International Edition in English 33(1) (1994) 115-117
Space group: P b c n
Cell volume: 4677.04
Cell parameters: 11.825; 21.268; 18.597; 90; 90; 90;

COD ID: 1100425

Formula: - C33 H33 B Cr2 O6 -
Comments: Elschenbroich, Christoph; Kühlkamp, Peter; Behrendt, Andreas; Harms, Klaus Metall-π-Komplexe von Benzolderivaten, 49. Halbsandwichkomplexe des Trimesitylborans Mes~3~B: Darstellung und Struktur von Mes~2~B[(η^6^-Mes)Cr(CO)~3~], MesB[(η^6^-Mes)Cr(CO)~3~]~2~ und B[(η^6^-Mes)Cr(CO)~3~]~3~. Redoxverhalten und Fragen der intramolekularen Wechselwirkung Chemische Berichte 129(7) (1996) 859-869
Space group: P b c n
Cell volume: 6258.04
Cell parameters: 33.631; 12.174; 15.285; 90; 90; 90;

COD ID: 1100551
CIF file	Formula: - C24 H72 N6 P4 Si4 Zn3 - Comments: Krieger, M.; Gould, R. O.; Neumüller, B.; Harms, K.; Dehnicke, K. Phosphaniminato-Komplexe des Zinks mit Hydrido-, Alkinylo-, Alkenylo- und Amido-Liganden Zeitschrift fuer Anorganische und Allgemeine Chemie 624(9) (1998) 1434-1442 Space group: P b c n Cell volume: 4901.2 Cell parameters: 11.647; 17.897; 23.513; 90; 90; 90;

COD ID: 1100562

Formula: - C14 H42 N2 Si5 -
Comments: Mommertz, Andreas; Geiseier, Gertraud; Harms, Klaus; Dehnicke, Kurt Kristallstrukturen von Me~2~Si[N(SiMe~3~)~2~]~2~ und [Me~2~Si(NPh)(NHPh)Li·OEt~2~]~2~ / Crystal Structures of Me~2~Si[N(SiMe~3~)~2~]~2~ and [Me~2~Si(NPh)(NHPh)Li·OEt~2~]~2~ Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences 53(9) (1998) 977-980
Space group: P b c n
Cell volume: 2435.31
Cell parameters: 14.878; 12.994; 12.597; 90; 90; 90;

COD ID: 1100975
CIF file	Formula: - C16 H20 Cl4 N8 Zn2 - Comments: Ruili Sang; Li Xu A Series of Single, Double, and Triple Me2biim-Bridged Dinuclear, Trinuclear, and Polymeric Complexes: Syntheses, Crystal Structures, and Luminescent Properties Inorganic Chemistry 44 (2005) 3731-3737 Space group: P b c n Cell volume: 2289.5 Cell parameters: 11.747; 13.566; 14.367; 90; 90; 90;

COD ID: 1101136

Formula: - C28 H36 Ag4 N16 O13 S3 -
Comments: Juan M. Salas; M. Angustias Romero; Abderrahman Rahmani; Miguel Quirós Dimeric complexes generated by the reaction of 5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine and silver sulphate: X-ray evidence of the coexistence of two different dimers in the same crystal Anales de Quimica, International Edition 92 (1996) 249-254
Space group: P b c n
Cell volume: 4145
Cell parameters: 16.778; 18.433; 13.403; 90; 90; 90;

COD ID: 1101137

Formula: - C14 H16 N8 O3 Pt S -
Comments: Navarro, Jorge A. R.; Romero, M. Angustias; Salas, Juan M.; Quirós, Miguel; El Bahraoui, Jaouad; Molina, José Binuclear Platinum(II) Triazolopyrimidine Bridged Complexes. Preparation, Crystal Structure, NMR Spectroscopy, and ab Initio MO Investigation on the Bonding Nature of the Pt(II)···Pt(II) Interaction in the Model Compound {Pt2[NHCHN(C(CH2)(CH3))]4}} Inorganic Chemistry 35(26) (1996) 7829-7835
Space group: P b c n
Cell volume: 3703.5
Cell parameters: 14.207; 15.187; 17.165; 90; 90; 90;

COD ID: 1502107
CIF file	Formula: - C13 H16 O4 - Comments: Egan, Ben A.; Paradowski, Michael; Thomas, Lynne H.; Marquez, Rodolfo Regiocontrolled rearrangement of isobenzofurans. Organic letters 13(8) (2011) 2086-2089 Space group: P b c n Cell volume: 2325.9 Cell parameters: 13.5; 15.178; 11.351; 90; 90; 90;

COD ID: 1502177

Formula: - C40 H58 O2 S2 -
Comments: Hachiya, Makoto; Ito, Mikinao; Matsuo, Tsukasa; Hashizume, Daisuke; Fueno, Hiroyuki; Tanaka, Kazuyoshi; Tamao, Kohei Air- and moisture-stable p-monothiobenzoquinones incorporated in an octaalkyl-s-hydrindacene skeleton. Organic letters 13(10) (2011) 2666-2669
Space group: P b c n
Cell volume: 3528.6
Cell parameters: 9.585; 15.461; 23.811; 90; 90; 90;

COD ID: 1502676

Formula: - B H7 N2 -
Comments: Mebs, Stefan; Grabowsky, Simon; Förster, Diana; Kickbusch, Rainer; Hartl, Monika; Daemen, Luke L.; Morgenroth, Wolfgang; Luger, Peter; Paulus, Beate; Lentz, Dieter Charge transfer via the dative N-B bond and dihydrogen contacts. Experimental and theoretical electron density studies of small Lewis acid-base adducts. The journal of physical chemistry. A 114(37) (2010) 10185-10196
Space group: P b c n
Cell volume: 625.37
Cell parameters: 12.974; 5.0702; 9.5069; 90; 90; 90;

COD ID: 1503091
CIF file	Formula: - C25 H16 Fe N2 O2 - Comments: Saha, Sukdeb; Ghosh, Amrita; Mahato, Prasenjit; Mishra, Sandhya; Mishra, Sanjiv K.; Suresh, E.; Das, Satyabrata; Das, Amitava Specific recognition and sensing of CN- in sodium cyanide solution. Organic letters 12(15) (2010) 3406-3409 Space group: P b c n Cell volume: 3804.8 Cell parameters: 27.672; 10.248; 13.417; 90; 90; 90;

COD ID: 1503161

Formula: - C27 H23 N2 O4.5 -
Comments: Gao, Meng; Yang, Yan; Wu, Yan-Dong; Deng, Cong; Shu, Wen-Ming; Zhang, Dong-Xue; Cao, Li-Ping; She, Neng-Fang; Wu, An-Xin An efficient synthesis of hydantoins via sustainable integration of coupled domino processes. Organic letters 12(18) (2010) 4026-4029
Space group: P b c n
Cell volume: 4522.9
Cell parameters: 11.301; 17.774; 22.517; 90; 90; 90;

COD ID: 1503246
CIF file	Formula: - C19 H19 Br O2 - Comments: Tang, Xiang-Ying; Wei, Yin; Shi, Min Thermally induced electrocyclic reaction of methylenecyclopropane methylene diketone derivatives: a facile method for the synthesis of spiro[2.5]octa-3,5-dienes. Organic letters 12(22) (2010) 5120-5123 Space group: P b c n Cell volume: 3434.5 Cell parameters: 25.683; 12.1372; 11.0178; 90; 90; 90;

COD ID: 1503476

Formula: - C48 H36 N2 O2 -
Comments: Jierry, Loïc; Harthong, Steven; Aronica, Christophe; Mulatier, Jean-Christophe; Guy, Laure; Guy, Stéphan Efficient dibenzo[c]acridine helicene-like synthesis and resolution: scaleup, structural control, and high chiroptical properties. Organic letters 14(1) (2012) 288-291
Space group: P b c n
Cell volume: 3504.5
Cell parameters: 11.4305; 25.443; 12.0501; 90; 90; 90;

COD ID: 1503629
CIF file	Formula: - C20 H22 N2 O5 - Comments: Chen, Fei; Feng, Zhang; He, Chun-Yang; Wang, Hao-Yang; Guo, Yin-Long; Zhang, Xingang Pd-catalyzed dehydrogenative cross-coupling of polyfluoroarenes with heteroatom-substituted enones. Organic letters 14(4) (2012) 1176-1179 Space group: P b c n Cell volume: 3679.8 Cell parameters: 15.278; 15.133; 15.916; 90; 90; 90;

COD ID: 1503950
CIF file	Formula: - C57.5 H40.5 Cl I2 O - Comments: Wang, Kung K.; Wang, Yu-Hsuan; Yang, Hua; Akhmedov, Novruz G.; Petersen, Jeffrey L. Synthesis of a C(56)H(40) hydrocarbon bearing a 54-carbon framework of C(60). Organic letters 11(12) (2009) 2527-2530 Space group: P b c n Cell volume: 17931 Cell parameters: 32.948; 17.014; 31.987; 90; 90; 90;

COD ID: 1504104
CIF file	Formula: - C27 H24 N2 O3 - Comments: Lin, Chi-Hui; Jhang, Jing-Fu; Yang, Ding-Yah One-pot synthesis of coumarin-based oxazabicyclic and oxazatricyclic compounds and their fluorescence redox switching properties. Organic letters 11(18) (2009) 4064-4067 Space group: P b c n Cell volume: 4710.2 Cell parameters: 33.2133; 7.9061; 17.9377; 90; 90; 90;

COD ID: 1504370

Formula: - C5 H7 O2 -
Comments: Piccoli, Paula M. B.; Koetzle, Thomas F.; Schultz, Arthur J.; Zhurova, Elizabeth A.; Stare, Jernej; Pinkerton, A. Alan; Eckert, Juergen; Hadzi, Dusan Variable temperature neutron diffraction and X-ray charge density studies of tetraacetylethane. The journal of physical chemistry. A 112(29) (2008) 6667-6677
Space group: P b c n
Cell volume: 958.1
Cell parameters: 9.064; 9.227; 11.456; 90; 90; 90;

COD ID: 1504371

Formula: - C5 H7 O2 -
Comments: Piccoli, Paula M. B.; Koetzle, Thomas F.; Schultz, Arthur J.; Zhurova, Elizabeth A.; Stare, Jernej; Pinkerton, A. Alan; Eckert, Juergen; Hadzi, Dusan Variable temperature neutron diffraction and X-ray charge density studies of tetraacetylethane. The journal of physical chemistry. A 112(29) (2008) 6667-6677
Space group: P b c n
Cell volume: 953
Cell parameters: 9.062; 9.216; 11.411; 90; 90; 90;

COD ID: 1504372

Formula: - C5 H7 O2 -
Comments: Piccoli, Paula M. B.; Koetzle, Thomas F.; Schultz, Arthur J.; Zhurova, Elizabeth A.; Stare, Jernej; Pinkerton, A. Alan; Eckert, Juergen; Hadzi, Dusan Variable temperature neutron diffraction and X-ray charge density studies of tetraacetylethane. The journal of physical chemistry. A 112(29) (2008) 6667-6677
Space group: P b c n
Cell volume: 962.4
Cell parameters: 9.079; 9.247; 11.464; 90; 90; 90;

COD ID: 1504373

Formula: - C5 H7 O2 -
Comments: Piccoli, Paula M. B.; Koetzle, Thomas F.; Schultz, Arthur J.; Zhurova, Elizabeth A.; Stare, Jernej; Pinkerton, A. Alan; Eckert, Juergen; Hadzi, Dusan Variable temperature neutron diffraction and X-ray charge density studies of tetraacetylethane. The journal of physical chemistry. A 112(29) (2008) 6667-6677
Space group: P b c n
Cell volume: 964.9
Cell parameters: 9.099; 9.225; 11.495; 90; 90; 90;

COD ID: 1504374

Formula: - C5 H7 O2 -
Comments: Piccoli, Paula M. B.; Koetzle, Thomas F.; Schultz, Arthur J.; Zhurova, Elizabeth A.; Stare, Jernej; Pinkerton, A. Alan; Eckert, Juergen; Hadzi, Dusan Variable temperature neutron diffraction and X-ray charge density studies of tetraacetylethane. The journal of physical chemistry. A 112(29) (2008) 6667-6677
Space group: P b c n
Cell volume: 1008.6
Cell parameters: 9.12; 9.359; 11.817; 90; 90; 90;

COD ID: 1504375

Formula: - C10 H14 O4 -
Comments: Piccoli, Paula M. B.; Koetzle, Thomas F.; Schultz, Arthur J.; Zhurova, Elizabeth A.; Stare, Jernej; Pinkerton, A. Alan; Eckert, Juergen; Hadzi, Dusan Variable temperature neutron diffraction and X-ray charge density studies of tetraacetylethane. The journal of physical chemistry. A 112(29) (2008) 6667-6677
Space group: P b c n
Cell volume: 962.7
Cell parameters: 9.0859; 9.2413; 11.465; 90; 90; 90;

COD ID: 1504710
CIF file	Formula: - C28 H28 N9.33 - Comments: Zhang, En-Xuan; Wang, De-Xian; Zheng, Qi-Yu; Wang, Mei-Xiang Synthesis of large macrocyclic azacalix[n]pyridines (n = 6 - 9) and their complexation with fullerenes C(60) and C(70). Organic letters 10(12) (2008) 2565-2568 Space group: P b c n Cell volume: 3813.8 Cell parameters: 27.601; 15.053; 9.1793; 90; 90; 90;

COD ID: 1504787
CIF file	Formula: - C26 H10 S8 - Comments: Beer, Leanne; Reed, Robert W.; Robertson, Craig M.; Oakley, Richard T.; Tham, Fook S.; Haddon, Robert C. Tetrathiophenalenyl radical and its disulfide-bridged dimer. Organic letters 10(14) (2008) 3121-3123 Space group: P b c n Cell volume: 2123.1 Cell parameters: 18.403; 8.002; 14.417; 90; 90; 90;

COD ID: 1504913
CIF file	Formula: - C94 H76 Cl4 N8 O8 - Comments: Ikeda, Chusaku; Sakamoto, Naoya; Nabeshima, Tatsuya Synthesis and guest recognition ability of 2,3-dimethoxy-1,4-phenylene-containing porphyrinoids. Organic letters 10(20) (2008) 4601-4604 Space group: P b c n Cell volume: 8272 Cell parameters: 22.06; 12.69; 29.55; 90; 90; 90;

COD ID: 1505159

Formula: - C22 H30 N2 S3 -
Comments: Pang, Hao; Skabara, Peter J.; Crouch, David J.; Duffy, Warren; Heeney, Martin; McCulloch, Iain; Coles, Simon J.; Horton, Peter N.; Hursthouse, Michael B. Structural and Electronic Effects of 1,3,4-Thiadiazole Units Incorporated into Polythiophene Chains Macromolecules 40(18) (2007) 6585
Space group: P b c n
Cell volume: 4492.1
Cell parameters: 38.741; 12.0548; 9.6188; 90; 90; 90;

COD ID: 1505160

Formula: - C22 H30 N2 S Se2 -
Comments: Pang, Hao; Skabara, Peter J.; Crouch, David J.; Duffy, Warren; Heeney, Martin; McCulloch, Iain; Coles, Simon J.; Horton, Peter N.; Hursthouse, Michael B. Structural and Electronic Effects of 1,3,4-Thiadiazole Units Incorporated into Polythiophene Chains Macromolecules 40(18) (2007) 6585
Space group: P b c n
Cell volume: 4544.1
Cell parameters: 38.796; 12.1462; 9.6432; 90; 90; 90;

COD ID: 1505381
CIF file	Formula: - C28 H35 N3 O2 S - Comments: Xu, Xiaoliang; Cheng, Dongping; Li, Jinghua; Guo, Hongyun; Yan, Jie Copper-catalyzed highly efficient multicomponent reactions: synthesis of 2-(sulfonylimino)-4-(alkylimino)azetidine derivatives. Organic letters 9(8) (2007) 1585-1587 Space group: P b c n Cell volume: 5215.5 Cell parameters: 17.22; 11.154; 27.154; 90; 90; 90;

COD ID: 1505766

Formula: - C20 H4 Cs Er F24 O8 -
Comments: Tan, Rendy H. C.; Motevalli, Majid; Abrahams, Isaac; Wyatt, Peter B.; Gillin, William P. Quenching of IR luminescence of erbium, neodymium, and ytterbium beta-diketonate complexes by ligand C-H and C-D bonds. The journal of physical chemistry. B 110(48) (2006) 24476-24479
Space group: P b c n
Cell volume: 3119
Cell parameters: 8.534; 21.189; 17.251; 90; 90; 90;

COD ID: 1506187
CIF file	Formula: - C32 H40 O6 - Comments: Bérubé, Amélie; Drutu, Ioana; Wood, John L. Progress toward the total synthesis of bacchopetiolone: application of a tandem aromatic oxidation/Diels-Alder reaction. Organic letters 8(24) (2006) 5421-5424 Space group: P b c n Cell volume: 2814.9 Cell parameters: 26.12; 9.092; 11.853; 90; 90; 90;

COD ID: 1506707
CIF file	Formula: - C32 H28 Cl4 N4 O4 - Comments: Chou, Teh-Chang; Liao, Kung-Ching; Lin, Jin-Ju Synthesis and luminescence properties of U-shaped polycyclic molecules containing syn-facial functionalized quinoxaline rings. Organic letters 7(22) (2005) 4843-4846 Space group: P b c n Cell volume: 3035.3 Cell parameters: 20.395; 11.2144; 13.2709; 90; 90; 90;

COD ID: 1507216

Formula: - C22 H16 N6 O10 -
Comments: Akutagawa, Tomoyuki; Uchimaru, Tadafumi; Sakai, Ken-ichi; Hasegawa, Tatsuo; Nakamura, Takayoshi Bidentated Hydrogen Bond from [O−H···N−N···H−O] to [O-···+H−N−N−H+···-O] Structures in Solids The Journal of Physical Chemistry B 107(26) (2003) 6248
Space group: P b c n
Cell volume: 2347.4
Cell parameters: 15.0526; 7.086; 22.0077; 90; 90; 90;

COD ID: 1507378
CIF file	Formula: - C22 H24 N2 O4 S2 - Comments: Azumaya, Isao; Kato, Takako; Okamoto, Iwao; Yamasaki, Ryu; Tanatani, Aya; Yamaguchi, Kentaro; Kagechika, Hiroyuki; Takayanagi, Hiroaki Absolute helical arrangement of sulfonamide in the crystal. Organic letters 5(21) (2003) 3939-3942 Space group: P b c n Cell volume: 2197 Cell parameters: 11.994; 11.904; 15.388; 90; 90; 90;

COD ID: 1507782
CIF file	Formula: - C44 H32 Cl4 Cu2 N4 O4 - Comments: Selvakumar, P M; Nadella, N; Prathap, K J; Kureshy, R I; Suresh, E; Subramanian, P S Synthesis, Crystal Structure and Catalytic studies on Dinuclear Cu(II)-Mesocates Inorganica Chimica Acta 375(1) (2011) 106-113 Space group: P b c n Cell volume: 4067 Cell parameters: 12.891; 13.324; 23.68; 90; 90; 90;

COD ID: 1507870
CIF file	Formula: - C18 H28 N2 O3 - Comments: Snyder, Seth E.; Huang, Bin-Syuan; Chen, Yu-Tzu; Lin, Huei-Shian; Carey, James R. A simple chiral recognition system to investigate substituent effects on π-π interactions. Organic letters 14(13) (2012) 3442-3445 Space group: P b c n Cell volume: 3916.8 Cell parameters: 18.1522; 11.5989; 18.603; 90; 90; 90;

COD ID: 1507924

Formula: - C25 H20 O6 -
Comments: Schickea, Olivier; Faurea, Bruno; Giorgib, Michel; Simaana, A. Jalila; Reglier, Marius Binuclear copper(II) complexes 1: Synthesis, characterization and evaluation of a new complex in phosphatase-like activity Inorganica Chimica Acta 391 (2012) 189-194
Space group: P b c n
Cell volume: 4011.6
Cell parameters: 10.329; 14.725; 26.376; 90; 90; 90;

COD ID: 1508032
CIF file	Formula: - C24 N3 O40 P V2 W10 - Comments: Kamata, Keigo; Yonehara, Kazuhiro; Nakagawa, Yoshinao; Uehara, Kazuhiro; Mizuno, Noritaka Efficient stereo- and regioselective hydroxylation of alkanes catalysed by a bulky polyoxometalate. Nature chemistry 2(6) (2010) 478-483 Space group: P b c n Cell volume: 7600.92 Cell parameters: 15.5486; 21.1547; 23.1083; 90; 90; 90;

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

COD ID: 1508916
CIF file	Formula: - C18 H18 Cu N6 S2 - Comments: Palanimuthu, Duraippandi; Shinde, Sridevi Vijay; Somasundaram, Kumaravel; Samuelson, Ashoka G. In Vitro and in Vivo Anticancer Activity of Copper Bis(thiosemicarbazone) Complexes. Journal of medicinal chemistry 56(3) (2013) 722-734 Space group: P b c n Cell volume: 1897.4 Cell parameters: 31.372; 7.5677; 7.9918; 90; 90; 90;

COD ID: 1509212
CIF file	Formula: - Ag B O2 - Comments: Brachtel, G.; Jansen, M. Silber(I)-metaborat, Ag B O2 Zeitschrift fuer Anorganische und Allgemeine Chemie 478 (1981) 13-19 Space group: P b c n Cell volume: 1446.38 Cell parameters: 8.441; 8.68; 19.741; 90; 90; 90;

COD ID: 1510039
CIF file	Formula: - Ag3 S2 Tl - Comments: Elfwing, T.; Eriksson, L. Synthesis and crystal structure determination of TlAg~3~S~2~ Materials Science Forum 166-169 (1994) 683-686 Space group: P b c n Cell volume: 504.244 Cell parameters: 8.1597; 8.7932; 7.0278; 90; 90; 90;

COD ID: 1510398
CIF file	Formula: - Au2 Eu4 O9 - Comments: Jansen, M.; Figulla-Kroschel, C. Darstellung, Kristallstrukturen und Eigenschaften von Ln4 Au2 O9 (Ln= Nd, Sm, Eu) Zeitschrift fuer Anorganische und Allgemeine Chemie 626 (2000) 2178-2184 Space group: P b c n Cell volume: 836.15 Cell parameters: 11.8241; 5.9922; 11.8013; 90; 90; 90;

COD ID: 1510407
CIF file	Formula: - Au2 F9 Lu - Comments: Engelmann, U.; Mueller, B.G. Tetrafluoroaurate(III) der Lanthaniden MF(AuF4)2 (M = Tm, Yb, Lu) Zeitschrift fuer Anorganische und Allgemeine Chemie 619 (1993) 1661-1668 Space group: P b c n Cell volume: 2130.25 Cell parameters: 10.9928; 9.007; 21.515; 90; 90; 90;

COD ID: 1510408
CIF file	Formula: - Au2 F9 Tm - Comments: Mueller, B.G.; Engelmann, U. Tetrafluoroaurate(III) der Lanthaniden M F (Au F4)2 (M= Tm, Yb, Lu) Zeitschrift fuer Anorganische und Allgemeine Chemie 619 (1993) 1661-1668 Space group: P b c n Cell volume: 2158.96 Cell parameters: 11.0292; 9.0438; 21.6446; 90; 90; 90;

COD ID: 1510409
CIF file	Formula: - Au2 F9 Yb - Comments: Engelmann, U.; Mueller, B.G. Tetrafluoroaurate(III) der Lanthaniden MF(AuF4)2 (M = Tm, Yb, Lu) Zeitschrift fuer Anorganische und Allgemeine Chemie 619 (1993) 1661-1668 Space group: P b c n Cell volume: 2142.99 Cell parameters: 11.0098; 9.0223; 21.5736; 90; 90; 90;

COD ID: 1510442
CIF file	Formula: - Au2 La4 O9 - Comments: Ralle, M.; Jansen, M. Darstellung und Kristallstruktur des neuen Lanthanaurates La4 Au2 O9 Journal of Alloys Compd. 203 (1994) 7-13 Space group: P b c n Cell volume: 927.462 Cell parameters: 12.1216; 6.3199; 12.1067; 90; 90; 90;

COD ID: 1510450
CIF file	Formula: - Au2 Nd4 O9 - Comments: Figulla-Kroschel, C.; Jansen, M. Darstellung, Kristallstrukturen und Eigenschaften von Ln4 Au2 O9 (Ln= Nd, Sm, Eu) Zeitschrift fuer Anorganische und Allgemeine Chemie 626 (2000) 2178-2184 Space group: P b c n Cell volume: 881.202 Cell parameters: 11.9813; 6.1474; 11.9641; 90; 90; 90;

COD ID: 1510453
CIF file	Formula: - Au2 O9 Sm4 - Comments: Figulla-Kroschel, C.; Jansen, M. Darstellung, Kristallstrukturen und Eigenschaften von Ln4 Au2 O9 (Ln= Nd, Sm, Eu) Zeitschrift fuer Anorganische und Allgemeine Chemie 626 (2000) 2178-2184 Space group: P b c n Cell volume: 848.72 Cell parameters: 11.8689; 6.036; 11.8469; 90; 90; 90;

COD ID: 1510567
CIF file	Formula: - Au5 Na7 S6 - Comments: Brunnbauer, G.; Klepp, K.O. Na7Au5S6 - a novel thioaurate(I) based on a b.c.c. chalcogen packing Journal of Alloys Compd. 183 (1992) 252-262 Space group: P b c n Cell volume: 1630.57 Cell parameters: 10.424; 7.024; 22.27; 90; 90; 90;

COD ID: 1512618

Formula: - C64 H64 N2 O2 Zn -
Comments: Zihong Zhou; Wen Li; Xiaohua Hou; Xiang Hao; Langqiu Chen; Carl Redshaw; Wen-Hua Sun Synthesis, structure and photophysical properties of 2-benzhydryl-4-methyl-6-(aryliminomethyl)phenol ligands and the zinc complexes thereof Inorganica Chimica Acta 392 (2012) 292-299
Space group: P b c n
Cell volume: 6073.4
Cell parameters: 21.925; 16.424; 16.866; 90; 90; 90;

COD ID: 1512659

Formula: - C29 H22 Cl2 Cu N6 O8 -
Comments: Feng Xu; Tao Tao; Qian-Qian Liu; Jiao Geng; Wei Huang A special case of copper(II) complex having monodentate and uncoordinated 4-aminopyridine molecules stabilized by highly cooperative supramolecular interactions Inorganica Chimica Acta 392 (2012) 465-468
Space group: P b c n
Cell volume: 5960
Cell parameters: 28.604; 16.487; 12.638; 90; 90; 90;

COD ID: 1512660

Formula: - C94 H68 Cl6 Cu3 N18 O24 -
Comments: Feng Xu; Tao Tao; Qian-Qian Liu; Jiao Geng; Wei Huang A special case of copper(II) complex having monodentate and uncoordinated 4-aminopyridine molecules stabilized by highly cooperative supramolecular interactions Inorganica Chimica Acta 392 (2012) 465-468
Space group: P b c n
Cell volume: 9448
Cell parameters: 46.466; 16.21; 12.543; 90; 90; 90;

COD ID: 1512694

Formula: - C40 H56 N4 O14 Pt2 -
Comments: Esther Escribano; Merce Font-Bardia; Teresa Calvet; Julia Lorenzo; Patrick Gamez; Virtudes Moreno DNA binding studies of a series of cis-[Pt(Am)2X2] complexes (Am = inert amine, X = labile carboxylato ligand) Inorganica Chimica Acta 393 (2012) 65-76
Space group: P b c n
Cell volume: 4451
Cell parameters: 20.459; 10.684; 20.362; 90; 90; 90;

COD ID: 1512713

Formula: - C16 H12 N2 O8 Zn -
Comments: Yong-Qing Huang; Yan-Hua Wang; Yue Zhao; Qian Zhao; Yang Yang; Wei Zhao; Qian Shao Syntheses, structures and photoluminescent properties of three new coordination polymers based on semirigid zwitterionic ligand Inorganica Chimica Acta 393 (2012) 164-170
Space group: P b c n
Cell volume: 1552.9
Cell parameters: 14.3015; 7.1697; 15.1451; 90; 90; 90;

COD ID: 1512823

Formula: - C37 H48 N4 Ni2 O9 S2 -
Comments: Moussa Dieng; Ousmane Diouf; Mohamed Gaye; Abdou Salam Sall; Paulo Perez-Lourido; Laura Valencia; Andrea Caneschi; Lorenzo Sorace Polynuclear nickel(II) complexes with salicylaldimine derivative ligands Inorganica Chimica Acta 394 (2013) 741-746
Space group: P b c n
Cell volume: 4332.7
Cell parameters: 13.8664; 14.8691; 21.014; 90; 90; 90;

COD ID: 1512930
CIF file	Formula: - C12 H24 Br3 O3 Sc - Comments: Timothy J. Boyle; Leigh Anna M. Ottley; Todd M. Alam; Mark A. Rodriguez; Pin Yang; Sarah K. Mcintyre Structural characterization of methanol substituted lanthanum halides Polyhedron 29(7) (2010) 1784-1795 Space group: P b c n Cell volume: 1773.1 Cell parameters: 8.783; 13.884; 14.54; 90; 90; 90;

COD ID: 1513005
CIF file	Formula: - C21 H31 Cu2 Mo5 N14 O23 P2 - Comments: Jency Thomas; Dinesh Kumar; Arunachalam Ramanan Crystallization of phosphomolybdate clusters mediated by copper azole complexes: Influence of pH and temperature Inorganica Chimica Acta 396 (2013) 126-135 Space group: P b c n Cell volume: 4258.1 Cell parameters: 8.8032; 23.534; 20.553; 90; 90; 90;

COD ID: 1513179

Formula: - C16 H12 Cl N3 O3 Zn -
Comments: Fei Yuan; Qiao-E Zhu; Huai-Ming Hu; Juan Xie; Bing Xu; Chun-Mei Yuan; Meng-Lin Yang; Fa-Xin Dong; Gang-Lin Xue Three novel coordination polymers based on bifunctionalized ligand 4'-carboxy-4,2':6',4'-terpyridine Inorganica Chimica Acta 397 (2013) 117-123
Space group: P b c n
Cell volume: 3157.1
Cell parameters: 20.452; 7.2803; 21.203; 90; 90; 90;

COD ID: 1513245
CIF file	Formula: - C11 H14 O2 - Comments: Cornella, Josep; Martin, Ruben Ni-Catalyzed Stereoselective Arylation of Inert C-O bonds at Low Temperatures. Organic letters 15(24) (2013) 6298-6301 Space group: P b c n Cell volume: 1946.8 Cell parameters: 44.087; 7.0736; 6.2427; 90; 90; 90;

COD ID: 1513281
CIF file	Formula: - C30 H28 B10 - Comments: Kokado, Kenta; Tokoro, Yuichiro; Chujo, Yoshiki Luminescentm-Carborane-Based π-Conjugated Polymer Macromolecules 42(8) (2009) 2925 Space group: P b c n Cell volume: 2729 Cell parameters: 11.167; 7.445; 32.828; 90; 90; 90;

COD ID: 1513387
CIF file	Formula: - C21 H34 O5 - Comments: He, Shuzhong; Yang, Wei; Zhu, Lizhi; Du, Guangyan; Lee, Chi-Sing Bioinspired Total Synthesis of (±)-Yezo'otogirin C. Organic letters 16(2) (2014) 496-499 Space group: P b c n Cell volume: 4120.2 Cell parameters: 23.5047; 13.3187; 13.1615; 90; 90; 90;

COD ID: 1513558
CIF file	Formula: - C74 H83 F6 N7 O15 P - Comments: Wei, Peifa; Li, Jinying; Yan, Xuzhou; Zhou, Qizhong Metallosupramolecular poly[2]pseudorotaxane constructed by metal coordination and crown-ether-based molecular recognition. Organic letters 16(1) (2014) 126-129 Space group: P b c n Cell volume: 8303.7 Cell parameters: 19.2525; 26.897; 16.0354; 90; 90; 90;

COD ID: 1515117
CIF file	Formula: - C10 H10 B2 N2 - Comments: Marwitz, Adam J. V.; Lamm, Ashley N.; Zakharov, Lev N.; Vasiliu, Monica; Dixon, David A.; Liu, Shih-Yuan BN-substituted diphenylacetylene: a basic model for conjugated π-systems containing the BN bond pair Chemical Science 3(3) (2012) 825 Space group: P b c n Cell volume: 1951.2 Cell parameters: 19.076; 9.301; 10.997; 90; 90; 90;

COD ID: 1515267

Formula: - C32 H28 N6 Si -
Comments: Liu, Jianzhao; Su, Huimin; Meng, Luming; Zhao, Yihua; Deng, Chunmei; Ng, Jason C. Y.; Lu, Ping; Faisal, Mahtab; Lam, Jacky W. Y.; Huang, Xuhui; Wu, Hongkai; Wong, Kam Sing; Tang, Ben Zhong What makes efficient circularly polarised luminescence in the condensed phase: aggregation-induced circular dichroism and light emission Chemical Science 3(9) (2012) 2737
Space group: P b c n
Cell volume: 2825.9
Cell parameters: 20.8494; 10; 13.5537; 90; 90; 90;

COD ID: 1515360

Formula: - C13 H19 Cl N2 S -
Comments: Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A. Towards predictable transmembrane transport: QSAR analysis of anion binding and transport Chemical Science 4(8) (2013) 3036
Space group: P b c n
Cell volume: 2852
Cell parameters: 13.987; 8.17; 24.959; 90; 90; 90;

COD ID: 1515412
CIF file	Formula: - C24 H34 - Comments: Bojase, Gomotsang; Nguyen, Thanh V.; Payne, Alan D.; Willis, Anthony C.; Sherburn, Michael S. Synthesis and properties of the ivyanes: the parent 1,1-oligocyclopropanes Chemical Science 2(2) (2011) 229 Space group: P b c n Cell volume: 1902.71 Cell parameters: 10.5317; 13.1456; 13.7434; 90; 90; 90;

COD ID: 1515911

Formula: - C29 H22 F6 S2 -
Comments: Kuroki, Lumi; Takami, Shizuka; Yoza, Kenji; Morimoto, Masakazu; Irie, Masahiro Photoinduced shape changes of diarylethene single crystals: correlation between shape changes and molecular packing. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 9(2) (2010) 221-225
Space group: P b c n
Cell volume: 2594.2
Cell parameters: 22.339; 10.971; 10.585; 90; 90; 90;

COD ID: 1515912

Formula: - C29 H22 F6 S2 -
Comments: Kuroki, Lumi; Takami, Shizuka; Yoza, Kenji; Morimoto, Masakazu; Irie, Masahiro Photoinduced shape changes of diarylethene single crystals: correlation between shape changes and molecular packing. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 9(2) (2010) 221-225
Space group: P b c n
Cell volume: 2592
Cell parameters: 22.3; 11.026; 10.542; 90; 90; 90;

COD ID: 1515913

Formula: - C27 H20 F6 N2 S2 -
Comments: Kuroki, Lumi; Takami, Shizuka; Yoza, Kenji; Morimoto, Masakazu; Irie, Masahiro Photoinduced shape changes of diarylethene single crystals: correlation between shape changes and molecular packing. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 9(2) (2010) 221-225
Space group: P b c n
Cell volume: 2517.7
Cell parameters: 21.5461; 10.8096; 10.8098; 90; 90; 90;

COD ID: 1515914

Formula: - C27 H20 F6 N2 S2 -
Comments: Kuroki, Lumi; Takami, Shizuka; Yoza, Kenji; Morimoto, Masakazu; Irie, Masahiro Photoinduced shape changes of diarylethene single crystals: correlation between shape changes and molecular packing. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 9(2) (2010) 221-225
Space group: P b c n
Cell volume: 2516.7
Cell parameters: 21.586; 10.8692; 10.7268; 90; 90; 90;

COD ID: 1515916

Formula: - C31 H26 F6 S2 -
Comments: Kuroki, Lumi; Takami, Shizuka; Yoza, Kenji; Morimoto, Masakazu; Irie, Masahiro Photoinduced shape changes of diarylethene single crystals: correlation between shape changes and molecular packing. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 9(2) (2010) 221-225
Space group: P b c n
Cell volume: 2771.8
Cell parameters: 21.307; 12.193; 10.669; 90; 90; 90;

COD ID: 1516103
CIF file	Formula: - C18 H24 N2 O - Comments: Zhao, Shu-Bin; Bilodeau, Eric; Lemieux, Valérie; Beauchemin, André M Hydrogen bonding directed intermolecular Cope-type hydroamination of alkenes. Organic letters 14(19) (2012) 5082-5085 Space group: P b c n Cell volume: 3355.1 Cell parameters: 18.945; 8.6958; 20.3655; 90; 90; 90;

COD ID: 1516377

Formula: - C22 H18 N2 -
Comments: Yang, Jye-Shane; Lin, Cheng-Kai; Lahoti, Anand M.; Tseng, Chung-Kai; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming Effect of ground-state twisting on the trans ‒> cis photoisomerization and TICT state formation of aminostilbenes. The journal of physical chemistry. A 113(17) (2009) 4868-4877
Space group: P b c n
Cell volume: 3403.4
Cell parameters: 12.7108; 7.8485; 34.116; 90; 90; 90;

COD ID: 1516506

Formula: - C28 H24 Cl2 F6 N6 O3 P Ru -
Comments: Chan, Siu-Chung; England, Jason; Wieghardt, Karl; Wong, Chun-Yuen Trapping of the putative 1,2-dinitrosoarene intermediate of benzofuroxan tautomerization by coordination at ruthenium and exploration of its redox non-innocence Chemical Science 5(10) (2014) 3883
Space group: P b c n
Cell volume: 6196.71
Cell parameters: 14.1173; 15.5837; 28.1669; 90; 90; 90;

COD ID: 1516584
CIF file	Formula: - C24 H12 Se2 - Comments: Xiong, Xiao-Dong; Deng, Chun-Lin; Peng, Xiao-Shui; Miao, Qian; Wong, Henry N. C. Heteroatom-bridged tetraphenylenes: synthesis, structures, and properties. Organic letters 16(12) (2014) 3252-3255 Space group: P b c n Cell volume: 3382 Cell parameters: 28.5952; 7.5369; 15.6922; 90; 90; 90;

COD ID: 1516657

Formula: - C28 H18 N4 O2 -
Comments: Leung, Man-kit; Yang, Chih-Chiang; Lee, Jiun-Haw; Tsai, Hsin-Hung; Lin, Chi-Feng; Huang, Chih-Yen; Su, Yuhlong Oliver; Chiu, Chi-Feng The unusual electrochemical and photophysical behavior of 2,2'-bis(1,3,4-oxadiazol-2-yl)biphenyls, effective electron transport hosts for phosphorescent organic light emitting diodes. Organic letters 9(2) (2007) 235-238
Space group: P b c n
Cell volume: 2163.81
Cell parameters: 11.3862; 10.0904; 18.8335; 90; 90; 90;

COD ID: 1516855

Formula: - C14 H24 B2 Fe N6 O6 -
Comments: Yan Z. Voloshin; Andrey Y. Lebedev; Valentin V. Novikov; Alexander V. Dolganov; Anna V. Vologzhanina; Ekaterina G. Lebed; Alexander A. Pavlov; Zoya A. Starikova; Michail I. Buzin; Yurii N. Bubnov Template synthesis, X-ray structure, spectral and redox properties of the paramagnetic alkylboron-capped cobalt(II) clathrochelates and their diamagnetic iron(II)-containing analogs Inorganica Chimica Acta 399 (2013) 67-78
Space group: P b c n
Cell volume: 3833.7
Cell parameters: 19.9212; 8.2523; 23.3202; 90; 90; 90;

COD ID: 1517034
CIF file	Formula: - C12 H8 N4 Ni - Comments: Bin Yuan; Min Min Yue; Ying Wang; Ju Yan Liu; Bin Ding; Xiao Jun Zhao Cyano-bridged assemblies induced by positive ions: Hydrothermal syntheses, crystal and powder X-ray structures, and magnetic properties Inorganica Chimica Acta 402 (2013) 1-5 Space group: P b c n Cell volume: 2278.5 Cell parameters: 14.173; 10.1535; 15.833; 90; 90; 90;

COD ID: 1517127

Formula: - C16 H18 Br2 Nb O4 -
Comments: Iva Klepalova; Jan Honzicek; Jaromir Vinklarek; Zdenka Padelkova; Lucie Sebestova; Martina Rezacova Vanadocene and niobocene dihalides containing electron-withdrawing substituents in the cyclopentadienyl rings: Synthesis, characterization and cytotoxicity Inorganica Chimica Acta 402 (2013) 109-115
Space group: P b c n
Cell volume: 1691.7
Cell parameters: 11.8; 6.913; 20.7381; 90; 90; 90;

COD ID: 1517390
CIF file	Formula: - C22 H18 B2 F8 N2 - Comments: Zhang, Xiaoping; Clennan, Edward L.; Arulsamy, Navamoney Photophysical and Electrochemical Characterization of a Helical Viologen, N,N'-Dimethyl-5,10-diaza[5]helicene. Organic letters 16(17) (2014) 4610 Space group: P b c n Cell volume: 2027.54 Cell parameters: 22.1736; 8.6842; 10.5294; 90; 90; 90;

COD ID: 1517573
CIF file	Formula: - C28 H34 Cd N4 O4 - Comments: Lu Liu; Yanhua Liu; Gang Han; Dongqing Wu; Hongwei Hou; Yaoting Fan A series of 2D coordination complexes constructed from a flexible bis(methylbenzimidazole) ligand and different dicarboxylates Inorganica Chimica Acta 403 (2013) 25-34 Space group: P b c n Cell volume: 2690.7 Cell parameters: 9.2186; 17.128; 17.041; 90; 90; 90;

COD ID: 1517662
CIF file	Formula: - C16 H13 N O4 S - Comments: Reddy, Mallu Chenna; Jeganmohan, Masilamani Ruthenium-Catalyzed Cyclization of Aromatic Nitriles with Alkenes: Stereoselective Synthesis of (Z)-3-Methyleneisoindolin-1-ones. Organic letters 16(18) (2014) 4866-4869 Space group: P b c n Cell volume: 2976 Cell parameters: 18.8157; 10.5029; 15.0591; 90; 90; 90;

COD ID: 1517683
CIF file	Formula: - C40 H36 Ag6 F10.5 N12 O16 S4.5 - Comments: He, Xin; Wang, Yuechao; Gao, Cai-Yan; Jiang, Hong; Zhao, Liang A macrocycle-assisted nanoparticlization process for bulk Ag2S Chem. Sci. 6(1) (2015) 654 Space group: P b c n Cell volume: 11624 Cell parameters: 12.772; 35.464; 25.664; 90; 90; 90;

COD ID: 1517705

Formula: - C16 H20 Cl2 N8 O2 Zn -
Comments: Bozidar Cobeljic; Andrej Pevec; Iztok Turel; Marcel Swart; Dragana Mitic; Marina Milenkovic; Ivanka Markovic; Maja Jovanovic; Dusan Sladic; Marko Jeremic; Katarina Andelkovic Synthesis, characterization, DFT calculations and biological activity of derivatives of 3-acetylpyridine and the zinc(II) complex with the condensation product of 3-acetylpyridine and semicarbazide Inorganica Chimica Acta 404 (2013) 5-12
Space group: P b c n
Cell volume: 2073.03
Cell parameters: 7.4381; 11.6257; 23.9731; 90; 90; 90;

COD ID: 1517719

Formula: - C27 H19.5 Cd2 N3 O10.25 -
Comments: Julie A. Wilson; Peter E. Kraft; Robert L. LaDuca Dipyridylamide isomer influenced dimensionality in luminescent cadmium phthalate coordination polymers with similar tetranuclear clusters and ribbon motifs Inorganica Chimica Acta 404 (2013) 97-104
Space group: P b c n
Cell volume: 5204.9
Cell parameters: 7.4378; 20.871; 33.529; 90; 90; 90;

COD ID: 1517730

Formula: - Nb1.91 O12 P2.82 -
Comments: Zah-Letho, J.J.; Verbaere, A.; Jouanneaux, A.; Taulelle, F.; Piffard, Y.; Tournoux, M. "Nb2-x P3-y O12", a novel Nb(V) oxophosphate with disordered cation vacancies in a Sc2 (W O4)3 - type structure Journal of Solid State Chemistry 116 (1995) 335-342
Space group: P b c n
Cell volume: 917.62
Cell parameters: 12.0819; 8.6848; 8.7452; 90; 90; 90;

COD ID: 1518113
CIF file	Formula: - Cr3 O12 Tl2 - Comments: Riou, A.; Gerault, Y.; Cudennec, Y. Determination structurale du chromate de thallium trivalent Tl2(CrO4)3 Revue de Chimie Minerale 23 (1986) 70-79 Space group: P b c n Cell volume: 975.7 Cell parameters: 12.869; 8.716; 8.6989; 90; 90; 90;

COD ID: 1518154

Formula: - C22 H22.5 B Cl Cr F4 N4.5 O3 -
Comments: Kotani, Hiroaki; Kaida, Suzue; Ishizuka, Tomoya; Sakaguchi, Miyuki; Ogura, Takashi; Shiota, Yoshihito; Yoshizawa, Kazunari; Kojima, Takahiko Formation and characterization of a reactive chromium(v)‒oxo complex: mechanistic insight into hydrogen-atom transfer reactions Chem. Sci. 6(2) (2015) 945
Space group: P b c n
Cell volume: 4874.5
Cell parameters: 14.5572; 13.9044; 24.0822; 90; 90; 90;

COD ID: 1518177
CIF file	Formula: - C51 H44 F12 N6 O13 P2 - Comments: Liu, Hua; Li, Xiao-Yan; Zhao, Xiao-Li; Liu, Yahu A.; Li, Jiu-Sheng; Jiang, Biao; Wen, Ke [2]Pseudorotaxanes and [2]catenanes constructed by oxacalixcrowns/viologen molecular recognition motifs. Organic letters 16(22) (2014) 5894-5897 Space group: P b c n Cell volume: 5835 Cell parameters: 16.4977; 18.1051; 19.5351; 90; 90; 90;

COD ID: 1518212
CIF file	Formula: - C24 H18 Au N3 O4 - Comments: Maity, Ayan; Sulicz, Amanda N.; Deligonul, Nihal; Zeller, Matthias; Hunter, Allen D.; Gray, Thomas G. Suzuki‒Miyaura coupling of arylboronic acids to gold(iii) Chem. Sci. 6(2) (2015) 981 Space group: P b c n Cell volume: 4130.7 Cell parameters: 11.1263; 14.1527; 26.2319; 90; 90; 90;

COD ID: 1518505

Formula: - C21 H24 N2 Se -
Comments: Vummaleti, Sai V. C.; Nelson, David J.; Poater, Albert; Gómez-Suárez, Adrián; Cordes, David B.; Slawin, Alexandra M. Z.; Nolan, Steven P.; Cavallo, Luigi What can NMR spectroscopy of selenoureas and phosphinidenes teach us about the π-accepting abilities of N-heterocyclic carbenes? Chem. Sci. 6(3) (2015) 1895
Space group: P b c n
Cell volume: 1904.4
Cell parameters: 16.043; 7.3937; 16.055; 90; 90; 90;

COD ID: 1518508

Formula: - C21 H26 N2 Se -
Comments: Vummaleti, Sai V. C.; Nelson, David J.; Poater, Albert; Gómez-Suárez, Adrián; Cordes, David B.; Slawin, Alexandra M. Z.; Nolan, Steven P.; Cavallo, Luigi What can NMR spectroscopy of selenoureas and phosphinidenes teach us about the π-accepting abilities of N-heterocyclic carbenes? Chem. Sci. 6(3) (2015) 1895
Space group: P b c n
Cell volume: 1918.2
Cell parameters: 15.9194; 7.4418; 16.1915; 90; 90; 90;

COD ID: 1518806

Formula: - C43 H59 F9 Mo2 N2 O9 -
Comments: Irene Mendoza; Natalia Curado; Mario Carrasco; Eleuterio Alvarez; Riccardo Peloso; Amor Rodriguez; Ernesto Carmona Synthesis and structure of mixed carboxylate-aminopyridinate and -amidinate complexes of dimolybdenum and ditungsten Inorganica Chimica Acta 424 (2015) 120-128
Space group: P b c n
Cell volume: 9743.5
Cell parameters: 32.864; 16.0484; 18.474; 90; 90; 90;

COD ID: 1518881
CIF file	Formula: - C30 H33 B N2 Si - Comments: Wang, M.; Xu, G.; Wang, D.; Zou, Y.; Frey, W.; Buchmeiser, M. R. Group 4 metal complexes bearing the aminoborane motif: origin of tandem ring-opening metathesis/vinyl-insertion polymerization Polym. Chem. 6(17) (2015) 3290 Space group: P b c n Cell volume: 5154.8 Cell parameters: 21.8109; 13.5026; 17.5034; 90; 90; 90;

COD ID: 1518907

Formula: - C34 H16 O2 -
Comments: Sbargoud, Kamal; Mamada, Masashi; Marrot, Jérôme; Tokito, Shizuo; Yassar, Abderrahim; Frigoli, Michel Diindeno[1,2-b:2′,1′-n]perylene: a closed shell related Chichibabin's hydrocarbon, the synthesis, molecular packing, electronic and charge transport properties Chem. Sci. 6(6) (2015) 3402
Space group: P b c n
Cell volume: 4351.5
Cell parameters: 18.9562; 15.493; 14.8168; 90; 90; 90;

COD ID: 1518995
CIF file	Formula: - C15 H21 N O4 S - Comments: Zhu, Haitao; Chen, Pinhong; Liu, Guosheng Palladium-catalyzed intramolecular aminoacetoxylation of unactivated alkenes with hydrogen peroxide as oxidant. Organic letters 17(6) (2015) 1485-1488 Space group: P b c n Cell volume: 3150 Cell parameters: 16.428; 13.329; 14.387; 90; 90; 90;

COD ID: 1519030
CIF file	Formula: - K12 Se35 Ta6 - Comments: Tougait, O.; Ibers, J. A. New tantalum polychalcogenides with infinite anionic chains : K12Ta6Se35 and KTaTe3 Solid State Sciences 1 (1999) 523-534 Space group: P b c n Cell volume: 6194 Cell parameters: 8.339; 13.259; 56.023; 90; 90; 90;

COD ID: 1519171
CIF file	Formula: - C25 H20 Fe2 S5 - Comments: Underhill, Allan E.; Hibbs, Dai E.; Hursthouse, Michael B. C25H20Fe2S5 Crystal Structure Report Archive (1996) 790 Space group: P b c n Cell volume: 2238.6 Cell parameters: 15.6; 10.877; 13.193; 90; 90; 90;

COD ID: 1519178
CIF file	Formula: - C8 H8 Cl N O - Comments: Hibbs, D. E.; Hursthouse, Michael B.; Coles, Simon J.; Barkley, J. V.; Roberts, S. M.; Gregory, R. J. H. 7-Chloro-6-cyano-6-hydroxybicyclo(3.2.0)hept-2-ene Crystal Structure Report Archive (1997) 104 Space group: P b c n Cell volume: 1533.09 Cell parameters: 22.689; 10.283; 6.571; 90; 90; 90;

COD ID: 1519202
CIF file	Formula: - C34 H28 Cl3 Fe O P2 Re - Comments: Butler, Ian R.; Coles, Simon J.; Hursthouse, Michael B. C34H28Cl3FeOP2Re Crystal Structure Report Archive (1998) 767 Space group: P b c n Cell volume: 3275.2 Cell parameters: 9.419; 15.687; 22.166; 90; 90; 90;

COD ID: 1519273
CIF file	Formula: - C13 H10 O S4 - Comments: Murphy, P. J.; Gelbrich, Thomas; Hursthouse, Michael B. C13H10OS4 Crystal Structure Report Archive (2000) 824 Space group: P b c n Cell volume: 1370.18 Cell parameters: 14.5002; 13.4816; 7.0091; 90; 90; 90;

COD ID: 1519292
CIF file	Formula: - C45 H31.5 N7.5 O9 - Comments: Light, Mark E.; Hursthouse, Michael B.; Gale, Phil A.; Camiolo, S. N,N'-bis(4-Nitrophenyl)-3,4-diphenyl-1H-pyrrole-2,5-dicarboxamide Crystal Structure Report Archive (2001) 120 Space group: P b c n Cell volume: 7624.1 Cell parameters: 32.285; 11.8982; 19.8475; 90; 90; 90;

COD ID: 1519425
CIF file	Formula: - C36 H34 Cu2 N8 O6 - Comments: Moore, Cameron M.; Szymczak, Nathaniel K. Nitrite reduction by copper through ligand-mediated proton and electron transfer Chem. Sci. 6(6) (2015) 3373 Space group: P b c n Cell volume: 3243.5 Cell parameters: 14.1161; 15.8051; 14.538; 90; 90; 90;

COD ID: 1519703

Formula: - C14 H8 Cu2 N8 O -
Comments: Yao, Peng-Fei; Li, Hai-Ye; Huang, Fu-Ping; Yu, Qing; Qin, Xao-Huan; Tang, Jie; Tao, Ye; Bian, He-Dong A series of multidimensional MOFs incorporating a new N-heterocyclic building block: 5,5′-di(pyridin-4-yl)-3,3′-bi(1,2,4-triazole) RSC Advances 5(60) (2015) 48596-48606
Space group: P b c n
Cell volume: 2951.9
Cell parameters: 14.6978; 19.3933; 10.356; 90; 90; 90;

COD ID: 1519736
CIF file	Formula: - C44 H36 Cl4 N16 O16 Zn2 - Comments: Matthews, Craig J.; Horton, Peter N.; Hursthouse, Michael B. C44H36Cl4N16O16Zn2 Crystal Structure Report Archive (2004) 990 Space group: P b c n Cell volume: 5114.7 Cell parameters: 17.648; 12.6089; 22.985; 90; 90; 90;

COD ID: 1519737
CIF file	Formula: - C44 H36 Cl4 Mn2 N16 O16 - Comments: Matthews, Craig J.; Horton, Peter N.; Hursthouse, Michael B. C44H36Cl4Mn2N16O16 Crystal Structure Report Archive (2004) 991 Space group: P b c n Cell volume: 5138.4 Cell parameters: 17.335; 12.828; 23.107; 90; 90; 90;

COD ID: 1519774
CIF file	Formula: - C36 H40 B4 Fe2 O8 - Comments: Aldridge, Simon; Male, Louise; Hursthouse, Michael B. C36H40B4Fe2O8 Crystal Structure Report Archive (2006) 329 Space group: P b c n Cell volume: 3300.6 Cell parameters: 19.6222; 7.8609; 21.3982; 90; 90; 90;

COD ID: 1520318
CIF file	Formula: - C19 H23.6 B F2 N2 O5.3 - Comments: Roßbach, Jan; Harms, Klaus; Koert, Ulrich α-Crotyl-α-difluoroboranyloxy-amides: Structure and Reactivity of Isolable Intermediates in Stereospecific α-Ketol Rearrangements. Organic letters 17(12) (2015) 3122-3125 Space group: P b c n Cell volume: 3841.8 Cell parameters: 12.2584; 10.1061; 31.0115; 90; 90; 90;

COD ID: 1520368
CIF file	Formula: - C12 H13 N O2 - Comments: Holliman, Peter J.; Horton, Peter N.; Hursthouse, Michael B. C12H13NO2 Crystal Structure Report Archive (2009) 718 Space group: P b c n Cell volume: 4290.4 Cell parameters: 39.9227; 8.317; 12.9213; 90; 90; 90;

COD ID: 1520620

Formula: - C26 H60 F N O6 -
Comments: Engle, Keary M.; Pfeifer, Lukas; Pidgeon, George W.; Giuffredi, Guy T.; Thompson, Amber L.; Paton, Robert S.; Brown, John M.; Gouverneur, Véronique Coordination diversity in hydrogen-bonded homoleptic fluoride‒alcohol complexes modulates reactivity Chem. Sci. 6(9) (2015) 5293
Space group: P b c n
Cell volume: 3157.54
Cell parameters: 9.9133; 17.3454; 18.3631; 90; 90; 90;

COD ID: 1521244

Formula: - Dy0.04 H0.08 Nb0.92 O6 Ti1.08 Y0.96 -
Comments: Johnsen, O.; Stahl, K.; Petersen, O.V.; Micheelsen, H.I. Structure refinement of natural non-metamict polycrase-(Y) from Zomba-Malosa complex, Malawi Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-) 1999 (1999) 1-10
Space group: P b c n
Cell volume: 425.621
Cell parameters: 14.6673; 5.5925; 5.1888; 90; 90; 90;

COD ID: 1525212
CIF file	Formula: - Al8.6 Ba3.32 Ca0.32 O96 Si39.9 - Comments: Schlenker, J.L.; Pluth, J.J.; Smith, J.V. Positions of cations and molecules in zeolites with the mordenite-type framework. (VI). Dehydrated barium mordenite Materials Research Bulletin 13 (1978) 169-174 Space group: P b c n Cell volume: 2709.64 Cell parameters: 17.974; 20.3199; 7.419; 90; 90; 90;

COD ID: 1525215
CIF file	Formula: - Al8.3 K0.2 Na7.3 O96 Si39.9 - Comments: Schlenker, J.L.; Pluth, J.J.; Smith, J.V. Positions of cations and molecules in zeolites with the mordenite-type framework. VIII Dehydrated sodium-exchanged mordenite Materials Research Bulletin 14 (1979) 751-758 Space group: P b c n Cell volume: 2722.39 Cell parameters: 17.92; 20.31; 7.48; 90; 90; 90;

COD ID: 1525761
CIF file	Formula: - H8 Na10 Np2 O40 S9 - Comments: Charushnikova, I.A.; Krot, N.N.; Starikova, Z.A. Crystal structure and spectral characteristics of double sodium neptunium(IV) sulfate Radiokhimiya 42 (2000) 36-39 Space group: P b c n Cell volume: 3331.64 Cell parameters: 27.259; 6.897; 17.721; 90; 90; 90;

COD ID: 1525833
CIF file	Formula: - Ge O2 - Comments: Lodziana, Z.; Parlinski, K.; Hafner, J. Ab initio studies of high-pressure transformations in Ge O2 Physical Review, Serie 3. B - Condensed Matter (18,1978-) 63 (2001) 1341061-1341067 Space group: P b c n Cell volume: 95.423 Cell parameters: 4.5792; 4.0956; 5.088; 90; 90; 90;

COD ID: 1526463
CIF file	Formula: - Li2.78 O12 P3 V1.8 Zr0.2 - Comments: Sato, M.; Ohkawa, H.; Yoshida, K.; Saito, M.; Uematsu, K.; Toda, K. Enhancement of discharge capacity of Li3 V2 (P O4)3 by stabilizing the orthorhombic phase at room temperature Solid State Ionics 135 (2000) 137-142 Space group: P b c n Cell volume: 906.28 Cell parameters: 12.1005; 8.6539; 8.6546; 90; 90; 90;

COD ID: 1527175
CIF file	Formula: - H11 N2 O7.5 S4 Se - Comments: Boyum, K.; Maroy, K. The crystal structure of ammonium elenopentathionate hemitrihydrate Acta Chemica Scandinavica (1-27,1973-42,1988) 25 (1971) 2569-2579 Space group: P b c n Cell volume: 2432.59 Cell parameters: 20.718; 9.326; 12.59; 90; 90; 90;

COD ID: 1527315
CIF file	Formula: - As K - Comments: Dunken, H.; Haase, W.; Schöunherr, F. Kristallstrukturuntersuchungen an Fluorverbindungen der V. Hauptgruppe; zur Kristallstruktur von Kaliummonohydroxopentafluoroarsenat Zeitschrift für Chemie 7(11) (1967) 442-443 Space group: P b c n Cell volume: 3065.43 Cell parameters: 28.3; 11.39; 9.51; 90; 90; 90;

COD ID: 1527451
CIF file	Formula: - Mn0.97 Nb0.72 O6 Ta1.28 Ti0.03 - Comments: Grice, J.D.; Ferguson, R.B.; Hawthorne, F.C. The crystal structures of tantalite, ixiolite and wodginite from Bernic Lake, Manitoba I. tantalite and ixiolite Canadian Mineralogist 14 (1976) 540-549 Space group: P b c n Cell volume: 422.068 Cell parameters: 14.413; 5.76; 5.084; 90; 90; 90;

COD ID: 1527452
CIF file	Formula: - Mn0.3 Nb0.24 O2 Ta0.42 Ti0.02 - Comments: Grice, J.D.; Ferguson, R.B.; Hawthorne, F.C. The crystal structures of tantalite, ixiolite and wodginite from bernic lake, manitoba I. Tantalite and ixiolite Canadian Mineralogist 14 (1976) 540-549 Space group: P b c n Cell volume: 142.168 Cell parameters: 4.785; 5.758; 5.16; 90; 90; 90;

COD ID: 1527724

Formula: - D3 K O6 Se2 -
Comments: Lehmann, M.S.; Larsen, F.K. The hydrogen bond system in potassium trihydrogen bis-selenite, K H3 (Se O3)2, and in potassium trideuterio bis- selenite K D3 (Se O3)2, as determined by neutron diffraction Acta Chemica Scandinavica (1-27,1973-42,1988) 25 (1971) 3859-3871
Space group: P b c n
Cell volume: 638.758
Cell parameters: 16.176; 6.259; 6.309; 90; 90; 90;

COD ID: 1527764
CIF file	Formula: - H3 K2 O7.5 S5 - Comments: Maroy, K. The crystal structure of potassium pentathionate hemitrihydrate Acta Chemica Scandinavica (1-27,1973-42,1988) 25 (1971) 2580-2590 Space group: P b c n Cell volume: 2296.46 Cell parameters: 20.316; 9.229; 12.248; 90; 90; 90;

COD ID: 1527765
CIF file	Formula: - H3 O7.5 Rb2 S4 Te - Comments: Maroy, K. The crystal structure of rubidium telluropentathionate hemitrihydrate Acta Chemica Scandinavica (1-27,1973-42,1988) 25 (1971) 2557-2568 Space group: P b c n Cell volume: 2504.67 Cell parameters: 21.32; 9.446; 12.437; 90; 90; 90;

COD ID: 1527881
CIF file	Formula: - C Mo2 - Comments: Norlund Christensen, A. A neutron diffraction investigation on a crystal of alpha-Mo2 C Acta Chemica Scandinavica, Series A: (28,1974-) 31 (1977) 509-511 Space group: P b c n Cell volume: 148.663 Cell parameters: 4.732; 6.037; 5.204; 90; 90; 90;

COD ID: 1528199
CIF file	Formula: - As Cu Se - Comments: Whitfield, H.J. The crystal structure of hcc-Cu As Se Journal of Solid State Chemistry 39 (1981) 209-214 Space group: P b c n Cell volume: 1532.62 Cell parameters: 11.75; 6.79; 19.21; 90; 90; 90;

COD ID: 1528627
CIF file	Formula: - Ba N2 O2 Si2 - Comments: Kechele, J.A.; Oeckler, O.; Schnick, W.; Stadler, F. Structure elucidation of Ba Si2 O2 N2 - A host lattice for rare-earth doped luminescent materials in phosphor-converted (pc)-LEDs Solid State Sciences 11 (2009) 537-543 Space group: P b c n Cell volume: 371.58 Cell parameters: 14.3902; 5.3433; 4.83254; 90; 90; 90;

COD ID: 1528870

Formula: - Bi38 Mo7 O78 -
Comments: Sharma, N.; Chen Yusheng; Christensen, M.; Macquart, R.B.; Avdeev, M.; Ling, C.D. Structure and crystal chemistry of fluorite-related Bi38 Mo7 O78 from single crystal X-ray diffraction and ab initio calculations Journal of Solid State Chemistry 182 (2009) 1312-1318
Space group: P b c n
Cell volume: 8192.25
Cell parameters: 28.7058; 16.8493; 16.9376; 90; 90; 90;

COD ID: 1529222
CIF file HKL data	Formula: - C8 H20 Ca N4 O11 S2 - Comments: Golovnev, Nicolay; Molokeev, Maxim; Vereshchagin, Sergey; Atuchin, Victor Calcium and strontium thiobarbiturates with discrete and polymeric structures Journal of Coordination Chemistry 66(23) (2013) 4119 Space group: P b c n Cell volume: 1861.2 Cell parameters: 12.9805; 8.4004; 17.069; 90; 90; 90;

COD ID: 1529268
CIF file HKL data	Formula: - Mo2 O8 Rb Sm - Comments: Atuchin, Victor; Chimitova, Olga; Adichtchev, S.; Bazarov, B.; Gavrilova, T.; Molokeev, Maxim; Surovtsev, N.; Bazarova, Zh. Synthesis, structural and vibrational properties of microcrystalline beta-RbSm(MoO4)2 Materials Letters 106 (2013) 26 Space group: P b c n Cell volume: 790.21 Cell parameters: 5.1431; 18.8195; 8.1641; 90; 90; 90;

COD ID: 1529358

Formula: - C6 H8 N8 O5 Zn -
Comments: Liu, Bing; Fernandes, José A; Tomé, João P C; Paz, Filipe A Almeida; Cunha-Silva, Luís Multidimensional Transition Metal Complexes Based on 3-Amino-1H-1,2,4-triazole-5-carboxylic Acid: From Discrete Mononuclear Complexes to Layered Materials. Molecules (Basel, Switzerland) 20(7) (2015) 12341-12363
Space group: P b c n
Cell volume: 1120.9
Cell parameters: 9.537; 6.865; 17.12; 90; 90; 90;

COD ID: 1529436
CIF file HKL data	Formula: - Mo2 Nd O8 Rb - Comments: V.V. Atuchin; O.D. Chimitova; T.A. Gavrilova; M.S. Molokeev; Sung-Jin Kim; N.V. Surovtsev; B.G. Bazarov Synthesis, structural and vibrational properties of microcrystalline RbNd(MoO4)2 Journal of Crystal Growth 318(1) (2011) 683-686 Space group: P b c n Cell volume: 799.71 Cell parameters: 5.1772; 18.7293; 8.2474; 90; 90; 90;

COD ID: 1529763
CIF file	Formula: - C2 H10 Cl2 Hg N6 S2 - Comments: Chieh, C. Synthesis and structure of dichlorobis(thiosemicarbazide) Mercury(II) Canadian Journal of Chemistry 55 (1977) 1583-1587 Space group: P b c n Cell volume: 1112.39 Cell parameters: 8.675; 8.123; 15.786; 90; 90; 90;

COD ID: 1529765
CIF file	Formula: - C2 H10 Br2 Hg N6 S2 - Comments: Chieh, C.; Lee, L.P.C.; Chiu, C. Thiosemicarbazide complexes of mercury(II) halides Canadian Journal of Chemistry 56 (1978) 2526-2529 Space group: P b c n Cell volume: 1207.86 Cell parameters: 8.825; 8.587; 15.939; 90; 90; 90;

COD ID: 1530007
CIF file	Formula: - H3 K O6 Se2 - Comments: Gorbatyii, L.V.; Ponomarev, V.I.; Heiker, D.M. About the crystal structures of the trihydroselenates of potassium K H3 (Se O3)2 and of sodium Na H3 (Se O3)2 Kristallografiya 16 (1971) 899-904 Space group: P b c n Cell volume: 635.908 Cell parameters: 16.15; 6.252; 6.298; 90; 90; 90;

COD ID: 1530026
CIF file	Formula: - O2 Ti - Comments: Grey, I.E.; Braunshausen, G.; Li, C.; Madsen, I.C. Ti O2-II. Ambient pressure and structure refinement Materials Research Bulletin 23 (1988) 743-753 Space group: P b c n Cell volume: 122.331 Cell parameters: 4.5318; 5.5019; 4.9063; 90; 90; 90;

COD ID: 1530063
CIF file	Formula: - Fe Nb O4 - Comments: Harrison, W.T.A.; Cheetham, A.K. Structural and Magnetic Properties of Fe Nb O4-II Materials Research Bulletin 24 (1989) 523-527 Space group: P b c n Cell volume: 130.761 Cell parameters: 4.6496; 5.6181; 5.0058; 90; 90; 90;

COD ID: 1530113
CIF file	Formula: - Fe H Na2 O5 P - Comments: Kabalov, Yu.K.; Belov, N.V.; Simonov, M.A. The crystal structure of sodium iron orthophosphate Na2 Fe (P O4) (O H) Doklady Akademii Nauk SSSR 215 (1974) 850-853 Space group: P b c n Cell volume: 853.043 Cell parameters: 5.227; 13.861; 11.774; 90; 90; 90;

COD ID: 1530184

Formula: - Al F5 H10 N2 O -
Comments: Knop, O.; Cameron, T.S.; Deraniyagala, S.P.; Adhikesavalu, D.; Falk, M. ... Part XIII. Crystal structure of (N H4)2 (Al F5 (H2 O)) and N H3 D+ probe-ion spectra in (N H4)2 (Al F5 (H2 O)), N H4 Al F4 and (N H4)3 Zn Cl5 with remarks on structural filiation of AMF4 fluorides Canadian Journal of Chemistry 63 (1985) 516-525
Space group: P b c n
Cell volume: 642.526
Cell parameters: 10.192; 8.037; 7.844; 90; 90; 90;

COD ID: 1530306
CIF file	Formula: - F O5 Ti2 Yb - Comments: Lobkovskaya, R.M.; Shcherbakova, L.G.; Kaminskii, V.F.; Sukhanova, G.E.; Kolesnikov, A.V.; Shibaeva, R.P. Synthesis and Crystal Structure of Yb Ti2 O5 F Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy 20 (1984) 873-876 Space group: P b c n Cell volume: 405.28 Cell parameters: 14.366; 5.48; 5.148; 90; 90; 90;

COD ID: 1530409
CIF file	Formula: - Ge Li Nd O4 - Comments: Merinov, B.V.; Maksimov, B.A.; Dem'yanets, L.N.; Belov, N.V. Crystal structure of Li Nd Ge O4 Doklady Akademii Nauk SSSR 250 (1980) 357-360 Space group: P b c n Cell volume: 328.041 Cell parameters: 5.096; 11.923; 5.399; 90; 90; 90;

COD ID: 1530585
CIF file	Formula: - O12 P2 S Zr2 - Comments: Piffard, Y.; Verbaere, A.; Kinoshita, M. beta- Zr2 (P O4)2 (S O4): A zirconium phosphato-sulfate with a Sc2 (W O4)3 structure. A comparison between garnet, Nasicon and Sc2 (W O4)3 structure types Journal of Solid State Chemistry 71 (1987) 121-130 Space group: P b c n Cell volume: 982.122 Cell parameters: 12.3742; 8.867; 8.951; 90; 90; 90;

COD ID: 1530782
CIF file	Formula: - Li Lu O8 S2 - Comments: Sirotinkin, S.P.; Pokrovskii, A.N.; Kovba, L.M. Crystal structures of certain double and simple rare earth sulfates Kristallografiya 26 (1981) 385-389 Space group: P b c n Cell volume: 1040.05 Cell parameters: 12.575; 9.051; 9.138; 90; 90; 90;

COD ID: 1530783
CIF file	Formula: - Er2 O12 S3 - Comments: Sirotinkin, S.P.; Pokrovskii, A.N.; Kovba, L.M. Crystal structures of certain double and simple rare earth sulfates Kristallografiya 26 (1981) 385-389 Space group: P b c n Cell volume: 1101.65 Cell parameters: 12.442; 9.001; 9.837; 90; 90; 90;

COD ID: 1530802
CIF file	Formula: - F5 Ga H10 N2 O - Comments: Soldatov, E.N.; Tananaev, I.V.; Vorotilina, T.B.; Ilyukhin, V.V.; Kuz'min, E.A.; Drozdov, Yu.N. Crystal structure of ammonium monoaquapentafluorogallate (N H4)2 Ga F5 * H2 O Doklady Akademii Nauk SSSR 241 (1978) 357-359 Space group: P b c n Cell volume: 657.928 Cell parameters: 10.33; 8.054; 7.908; 90; 90; 90;

COD ID: 1530893
CIF file	Formula: - Fe2 Li2 Mo3 O12 - Comments: Torardi, C.C.; Prince, E. Structure of the lithium insertion compound Li2 Fe2 (Mo O4)3 from neutron powder diffraction data Materials Research Bulletin 21 (1986) 719-726 Space group: P b c n Cell volume: 1144.57 Cell parameters: 12.8947; 9.4957; 9.3477; 90; 90; 90;

COD ID: 1530900
CIF file	Formula: - C3 H12 Cu N6 O7 S - Comments: Treushnikov, E.N.; Kuskov, V.I.; Belov, N.V. X-ray structural study of the electron structure of cupric sulfate tricarbamide Cu S O4 * 3C O (N H2)2 Kristallografiya 22 (1977) 994-1003 Space group: P b c n Cell volume: 1069.38 Cell parameters: 13.004; 9.268; 8.873; 90; 90; 90;

COD ID: 1530923

Formula: - F7 K4 N3 O9 Sb2 -
Comments: Udovenko, A.A.; Volkova, L.M.; Simonov, M.A.; Davidovich, R.L. Crystal structure of di- and trinitratoheptafluorodiantimonates(III) of potassium K (Sb2 F7) (K N O3)2 and K (Sb2 F7) (K N O3)3 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 5 (1979) 133-137
Space group: P b c n
Cell volume: 1544.15
Cell parameters: 8.613; 8.996; 19.929; 90; 90; 90;

COD ID: 1530959
CIF file	Formula: - F4 Na2 O2 W - Comments: Vlasse, M.; Moutou, J.M.; Cervera-Marzal, M.; Chaminade, J.P.; Hagenmuller, P. Structure de Na2 W O2 F4 Revue de Chimie Minerale 19 (1982) 58-64 Space group: P b c n Cell volume: 503.552 Cell parameters: 5.074; 18.253; 5.437; 90; 90; 90;

COD ID: 1531016
CIF file	Formula: - O2 Pb - Comments: Zaslavskii, A.I.; Kondrashev, Yu.D.; Tolkachev, S.S. The new modification of lead dioxide and the texture of anode sediments Doklady Akademii Nauk SSSR 75 (1950) 559-561 Space group: P b c n Cell volume: 161.862 Cell parameters: 4.948; 5.951; 5.497; 90; 90; 90;

COD ID: 1531208

Formula: - Ca0.012 Dy0.25 Fe0.018 H0.28 Nb0.335 O6 Ta0.05 Th0.157 Ti1.605 U0.056 W0.014 Y0.5 -
Comments: Bonazzi, P.; Zoppi, M.; Dei, L. Metamict aeschynite-(Y) from the Evje-Iveland district (Norway): heat-induced recrystallization and dehydrogenation European Journal of Mineralogy (1,1989-) 14 (2002) 141-150
Space group: P b c n
Cell volume: 419.704
Cell parameters: 14.5342; 5.5584; 5.1952; 90; 90; 90;

COD ID: 1531559
CIF file	Formula: - Ga6 O19 Sr10 - Comments: Kahlenberg, V. beta-(Sr10 Ga6 O19): an oxygen deficient perovskite containing (Ga6 O19)-polyanions Solid State Sciences 4 (2002) 183-189 Space group: P b c n Cell volume: 4321.11 Cell parameters: 34.3163; 7.8918; 15.9558; 90; 90; 90;

COD ID: 1531861
CIF file	Formula: - Ru2 Si3 - Comments: Migas, D.B.; Miglio, L.; Shaposhnikov, V.L.; Borisenko, V.E. Structural, electronic and optical properties of Ru2 Si3, Ru2 Ge3, Os2 Si3 and Os2 Ge3 Physica Status Solidi, Sectio B: Basic Research 231 (2002) 171-180 Space group: P b c n Cell volume: 537.822 Cell parameters: 10.991; 8.905; 5.495; 90; 90; 90;

COD ID: 1531867
CIF file	Formula: - Ge3 Ru2 - Comments: Migas, D.B.; Borisenko, V.E.; Miglio, L.; Shaposhnikov, V.L. Structural, electronic and optical properties of Ru2 Si3, Ru2 Ge3, Os2 Si3 and Os2 Ge3 Physica Status Solidi, Sectio B: Basic Research 231 (2002) 171-180 Space group: P b c n Cell volume: 587.23 Cell parameters: 11.333; 9.158; 5.658; 90; 90; 90;

COD ID: 1531873
CIF file	Formula: - Os2 Si3 - Comments: Migas, D.B.; Miglio, L.; Borisenko, V.E.; Shaposhnikov, V.L. Structural, electronic and optical properties of Ru2 Si3, Ru2 Ge3, Os2 Si3 and Os2 Ge3 Physica Status Solidi, Sectio B: Basic Research 231 (2002) 171-180 Space group: P b c n Cell volume: 549.75 Cell parameters: 11.094; 8.927; 5.551; 90; 90; 90;

COD ID: 1531878
CIF file	Formula: - Ge3 Os2 - Comments: Migas, D.B.; Miglio, L.; Shaposhnikov, V.L.; Borisenko, V.E. Structural, electronic and optical properties of Ru2 Si3, Ru2 Ge3, Os2 Si3 and Os2 Ge3 Physica Status Solidi, Sectio B: Basic Research 231 (2002) 171-180 Space group: P b c n Cell volume: 598.476 Cell parameters: 11.407; 9.19; 5.709; 90; 90; 90;

COD ID: 1532121
CIF file	Formula: - Fe2 O3 - Comments: Rozenberg, G.Kh.; Naaman, O.; Dubrovinskii, L.S.; Ahuja, R.; Le Bihan, T.; Pasternak, M.P. High-pressure structural studies of hematite Fe2 O3 Physical Review, Serie 3. B - Condensed Matter (18,1978-) 65 (2002) 064112-1-064112-8 Space group: P b c n Cell volume: 150.542 Cell parameters: 6.6428; 4.6003; 4.9263; 90; 90; 90;

COD ID: 1532146

Formula: - C24 H12 N6 O6 -
Comments: Zhan, Tian-Guang; Zhou, Tian-You; Qi, Qiao-Yan; Wu, Jian; Li, Guang-Yu; Zhao, Xin The construction of supramolecular polymers through anion bridging: from frustrated hydrogen-bonding networks to well-ordered linear arrays Polym. Chem. 6(43) (2015) 7586
Space group: P b c n
Cell volume: 6510
Cell parameters: 7.235; 41.244; 21.816; 90; 90; 90;

COD ID: 1532168
CIF file	Formula: - F Mg Na2 O4 P - Comments: Swafford, S.H.; Holt, E.M. New synthetic approaches to monophosphate fluoride ceramics: synthesis and structural characterization of Na2 Mg (P O4) F and Sr5 (P O4)3 F Solid State Sciences 4 (2002) 807-812 Space group: P b c n Cell volume: 847.942 Cell parameters: 5.223; 13.818; 11.749; 90; 90; 90;

COD ID: 1532231
CIF file	Formula: - Ca H4 O10 P2 Zn2 - Comments: Taxer, K.J. Die Kristallstruktur des Minerals Scholzit Naturwissenschaften 58 (1971) 192-192 Space group: P b c n Cell volume: 847.432 Cell parameters: 17.149; 7.412; 6.667; 90; 90; 90;

COD ID: 1532756
CIF file	Formula: - Mg0.857 Nb1.714 O6 Ti0.429 - Comments: Bruno, J.C.; Cavalheiro, A.A.; Zaghete, M.A.; Varela, J.A.; Cilense, M. Structural effects of Li and K additives on the columbite precursor and 0.9PMN - 0.1PT powders Materials Chemistry and Physics 84 (2004) 120-125 Space group: P b c n Cell volume: 404.906 Cell parameters: 14.136; 5.681; 5.042; 90; 90; 90;

COD ID: 1532785

Formula: - Li2 O10 U W2 -
Comments: Obbade, S.; Yagoubi, S.; Dion, C.; Saadi, M.; Abraham, F. Two new lithium uranyl tungstates Li2 (U O2) (W O4)2 and Li2 (U O2)4 (W O4)4 O with framework based on the uranophane sheet anion topology Journal of Solid State Chemistry 177 (2004) 1681-1694
Space group: P b c n
Cell volume: 753.516
Cell parameters: 7.9372; 12.786; 7.4249; 90; 90; 90;

COD ID: 1532829

Formula: - Fe0.794 Mn0.067 Nb1.578 O6 Sc0.047 Sn0.015 Ta0.078 Ti0.335 W0.044 -
Comments: Okrusch, M.; Brummer, A.; Hock, R.; Schuessler, U.; Baier, M.; Theisinger, H. Intergrown niobian rutile phases with Sc- and W-rich ferrocolumbite: an electron-microprobe and Rietveld study American Mineralogist 88 (2003) 986-995
Space group: P b c n
Cell volume: 408.636
Cell parameters: 14.174; 5.692; 5.065; 90; 90; 90;

COD ID: 1533491
CIF file	Formula: - C V2 - Comments: Arbuzov, M.P.; Khaenko, B.V.; Fak, V.G. Investigation of the Rhombic Modification of Carbide, V2 C Dopovidi Akademii Nauk Ukrains'koi RSR, Seriya A: Fiziko-Tekhnichni ta Matematichni Nauki 1977 (1977) 153-156 Space group: P b c n Cell volume: 131.887 Cell parameters: 4.57; 5.742; 5.026; 90; 90; 90;

COD ID: 1533881
CIF file	Formula: - C V2 - Comments: Khaenko, B.V. X-ray study of the crystal structure of carbide V2 C rhombic modification Dopovidi Akademii Nauk Ukrains'koi RSR, Seriya A: Fiziko-Matematichni Ta Tekhnichni Nauki 41 (1979) 387-391 Space group: P b c n Cell volume: 131.846 Cell parameters: 4.567; 5.744; 5.026; 90; 90; 90;

COD ID: 1533962
CIF file	Formula: - Al B O4 Pb - Comments: Park Hyun-Soo; Barbier, J.; Hammond, R.P. Crystal structure and polymorphism of Pb Al B O4 Solid State Sciences 5 (2003) 565-571 Space group: P b c n Cell volume: 657.243 Cell parameters: 7.0423; 9.8989; 9.4281; 90; 90; 90;

COD ID: 1534038
CIF file	Formula: - B10 Cs Cu H10 - Comments: Polyakova, I.N.; Malinina, E.A.; Kuznetsov, N.T. Crystal structures of cesium and dimethylammonium cupradecaborates, Cs (Cu B10 H10) and (C H3)2 N H2 (Cu B10 H10) Kristallografiya 48 (2003) 89-96 Space group: P b c n Cell volume: 1887.84 Cell parameters: 21.212; 9.216; 9.657; 90; 90; 90;

COD ID: 1534505
CIF file	Formula: - F6 Na Rb Sn - Comments: Gerasimenko, A.V.; Ivanov, S.B.; Sergienko, V.I.; Antokhina, T.F. Crystal structures of Na Rb Sn F6 and Na Cs Sn F6. Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 18 (1992) 1139-1143 Space group: P b c n Cell volume: 1173.38 Cell parameters: 8.156; 13.129; 10.958; 90; 90; 90;

COD ID: 1534509
CIF file	Formula: - Cs F6 Na Sn - Comments: Gerasimenko, A.V.; Ivanov, S.B.; Antokhina, T.F.; Sergienko, V.I. Crystal structures of NaRbSnF6 and NaCsSnF6. Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 18 (1992) 1139-1143 Space group: P b c n Cell volume: 1253.11 Cell parameters: 8.352; 13.389; 11.206; 90; 90; 90;

COD ID: 1534667
CIF file	Formula: - Ba Cl4 Pd - Comments: Assoud, A.; Meyer, G. Ein neues Chloropalladat(II): Ba Pd Cl4 Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 1246-1247 Space group: P b c n Cell volume: 648.443 Cell parameters: 6.867; 12.588; 7.5015; 90; 90; 90;

COD ID: 1535040
CIF file	Formula: - Mo3 O12 Y2 - Comments: Marinkovic, B.A.; Jardim, P.M.; Rizzo, F.; de Avillez, R.R. Crystal structure and negative thermal expansion of metastable Y2 Mo3 O12 Solid State Sciences 7 (2005) 1377-1383 Space group: P b c n Cell volume: 1380.82 Cell parameters: 13.86882; 9.93488; 10.02158; 90; 90; 90;

COD ID: 1535233
CIF file	Formula: - Ag6 H8 N2 S10 Sn3 - Comments: Baiyin, Menghe; Ye, Ling; An, Yonglin; Liu, Xin; Jia, Cuiying; Ning, Guiling A solvothermal synthesis and the structure of (NH~4~)~2~Ag~6~Sn~3~S~10~ Bulletin of the Chemical Society of Japan 78(7) (2005) 1283-1284 Space group: P b c n Cell volume: 2073.9 Cell parameters: 23.8579; 6.4875; 13.3992; 90; 90; 90;

COD ID: 1535550
CIF file	Formula: - As2 F13 H Pb - Comments: Tramsek, M.; Lork, E.; Zemva, B.; Mews, R. Synthesis and crystal structures of two new lead(II) hexafluoroarsenates(V) Journal of Fluorine Chemistry 110 (2001) 123-131 Space group: P b c n Cell volume: 1737.37 Cell parameters: 10.583; 15.209; 10.794; 90; 90; 90;

COD ID: 1535687
CIF file	Formula: - B6 Dy4 H2 O16 - Comments: Huppertz, H. Multianvil high-pressure/high-temperatuer preparation, crystal structure, and properties of the new oxoborates Dy4 B6 O14 (O H)2 and Ho4 B6 O14 (O H)2 Journal of Solid State Chemistry 177 (2004) 3700-3708 Space group: P b c n Cell volume: 501.542 Cell parameters: 12.9266; 4.3711; 8.8763; 90; 90; 90;

COD ID: 1535691
CIF file	Formula: - B6 H2 Ho4 O16 - Comments: Huppertz, H. Multianvil high-pressure/high-temperatuer preparation, crystal structure, and properties of the new oxoborates Dy4 B6 O14 (O H)2 and Ho4 B6 O14 (O H)2 Journal of Solid State Chemistry 177 (2004) 3700-3708 Space group: P b c n Cell volume: 500.262 Cell parameters: 12.9278; 4.362; 8.8713; 90; 90; 90;

COD ID: 1535839
CIF file	Formula: - F5 K2 Sb - Comments: Udovenko, A.A.; Eiberman, M.F.; Davidovich, R.L. X-ray investigation of sequential phase transitions in potassium pentafluoroantimonate(III) over a temperature range 323-98 K. II.Crystal structure. Kristallografiya 37 (1992) 735-752 Space group: P b c n Cell volume: 6105.96 Cell parameters: 68.81; 13.635; 6.508; 90; 90; 90;

COD ID: 1536520
CIF file	Formula: - Ba Cl4 Zn - Comments: Wickleder, C. Crystal structure, thermal behavior, and luminescence of Ba Zn Cl4 - II : Sm(2+) and comparison to Ba Zn Cl4 - I : Sm(2+) Journal of Solid State Chemistry 162 (2001) 237-242 Space group: P b c n Cell volume: 680.84 Cell parameters: 6.4899; 15.374; 6.8237; 90; 90; 90;

COD ID: 1536559

Formula: - H12 Na5 O33.5 Te4 -
Comments: Driess, M.; Merz, K.; Rowlings, R.B. Orthotelluric acid as substitute for crystal-water: syntheses and crystal structure of the co-crystallate (Te (O H)6 . 2 adenine . 4(H2 O)) and the disodium ditellurate(VI) aggregate ((Te2 O2 (O H)6 (O Na)2)2 (Na O H . 12.5(H2 O))) Zeitschrift fuer Anorganische und Allgemeine Chemie 627 (2001) 213-217
Space group: P b c n
Cell volume: 6139.61
Cell parameters: 17.215; 13.5405; 26.339; 90; 90; 90;

COD ID: 1536726
CIF file	Formula: - As11 Rb3 - Comments: Emmerling, F.; Roehr, C. Die Undecaarsenide A3 As11 (A = Rb, Cs) - Synthesen und Kristallstrukturen Zeitschrift fuer Anorganische und Allgemeine Chemie 629 (2003) 467-472 Space group: P b c n Cell volume: 1801.56 Cell parameters: 11.082; 15.335; 10.601; 90; 90; 90;

COD ID: 1536832
CIF file	Formula: - Cl6 H2 Ir K3 O - Comments: Rankin, D.A. The chloro and bromo complexes of iridium(III) and iridium(IV). II. Structural chemistry of Ir(III) complexes Australian Journal of Chemistry 36 (1983) 771-883 Space group: P b c n Cell volume: 2354.3 Cell parameters: 12.436; 15.682; 12.072; 90; 90; 90;

COD ID: 1536979

Formula: - Cl2 H14 O17 U -
Comments: Fischer, A. Competitive coordination of the uranyl ion by perchlorate and water - the crystal structures of U O2 (Cl O4)2 * 3(H2 O) and U O2 (Cl O4)2 * 5(H2 O) and a redetermination of U O2 (Cl O4)2 * 7(H2 O) Zeitschrift fuer Anorganische und Allgemeine Chemie 629 (2003) 1012-1016
Space group: P b c n
Cell volume: 1426.03
Cell parameters: 14.495; 9.216; 10.675; 90; 90; 90;

COD ID: 1537384
CIF file	Formula: - H16 Na4 O14 Xe - Comments: Hamilton, W.C.; Ibers, J.A.; MacKenzie, D.R. Geometry of the Perxenate Ion Science 141 (1963) 532-534 Space group: P b c n Cell volume: 1291.26 Cell parameters: 11.87; 10.47; 10.39; 90; 90; 90;

COD ID: 1537386
CIF file	Formula: - Hf O4 Ti - Comments: Harari, A.; Huber, M.; Bocquet, J.P.; Collongues, R. Structure cristalline de l'oxyde mixte Hf Ti O4 Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-) 267 (1968) 1316-1318 Space group: P b c n Cell volume: 135.384 Cell parameters: 4.758; 5.61; 5.072; 90; 90; 90;

COD ID: 1537545
CIF file	Formula: - Mn O5 Se2 - Comments: Koskenlinna, M.; Niinisto, L.; Valkonen, J. The crystal structure of manganese(II) diselenite Acta Chemica Scandinavica, Series A: (28,1974-) 30 (1976) 836-837 Space group: P b c n Cell volume: 454.632 Cell parameters: 6.797; 10.617; 6.3; 90; 90; 90;

COD ID: 1538358
CIF file	Formula: - O4 Ti Zr - Comments: Newnham, R.E. Crystal structure of Zr Ti O4 Journal of the American Ceramic Society 50 (1967) 216-216 Space group: P b c n Cell volume: 131.729 Cell parameters: 4.806; 5.447; 5.032; 90; 90; 90;

COD ID: 1539125
CIF file	Formula: - F7 H Na3 Nb O2 - Comments: Stomberg, R. The Crystal Structure of Trisodium Pentafluoroperoxoniobate(V) Hydrogendifluoride, Na3 (H F2) (Nb F5 (O2)) Acta Chemica Scandinavica, Series A: (28,1974-) 35 (1981) 389-394 Space group: P b c n Cell volume: 1415.18 Cell parameters: 6.703; 14.982; 14.092; 90; 90; 90;

COD ID: 1539224
CIF file	Formula: - Ge3 Ru2 - Comments: Voellenkle, H. Die Kristallstruktur von Ru2 Ge3 Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-) 105 (1974) 1217-1227 Space group: P b c n Cell volume: 604.213 Cell parameters: 11.436; 9.24; 5.718; 90; 90; 90;

COD ID: 1539301

Formula: - Mn0.33 O2 Ta0.67 -
Comments: Tarakina, N.V.; Tyutyunnik, A.P.; Zubkov, V.G.; D'yachkova, T.V.; Swensson, G.; Sayagues, M.; Zainulin, Yu.G. New phases in the Mn O - Nb (Ta)2 O5 system prepared by high-pressure high-temperature technique Zhurnal Strukturnoi Khimii (Issue-No. from 1981) 44 (2003) 286-289
Space group: P b c n
Cell volume: 140.367
Cell parameters: 4.7471; 5.7438; 5.148; 90; 90; 90;

COD ID: 1539497
CIF file	Formula: - Cd K2 O2 - Comments: Vielhaber, E.; Hoppe, R. Ueber Oxocadmate: Die Kristallstruktur von K2 Cd O2 Zeitschrift fuer Anorganische und Allgemeine Chemie 392 (1972) 209-217 Space group: P b c n Cell volume: 383.95 Cell parameters: 10.089; 6.186; 6.152; 90; 90; 90;

COD ID: 1539609

Formula: - Mn0.06 Nb0.84 O6 Ta0.16 Th0.06 Ti0.96 U0.46 Y0.42 -
Comments: Aurisicchio, C.; Orlandi, P.; Pasero, M.; Perchiazzi, N. Uranopolycrase, the uranium-dominant analogue of polycrase-(Y), a new mineral from Elba Island, Italy, and its crystal structure European Journal of Mineralogy (1,1989-) 5 (1993) 1161-1165
Space group: P b c n
Cell volume: 417.185
Cell parameters: 14.51; 5.558; 5.173; 90; 90; 90;

COD ID: 1539795
CIF file	Formula: - C Mo2 - Comments: Epicier, T.; Dubois, J.; Esnouf, C.; Fantozzi, G.; Convert, P. Neutron powder diffraction studies of transition metal hemicarbides M2 C1-x - II. In situ high temperature study on W2 C1-x and Mo2 C1-x Acta Metallurgica 36 (1988) 1903-1921 Space group: P b c n Cell volume: 148.633 Cell parameters: 4.735; 6.025; 5.21; 90; 90; 90;

COD ID: 1540281

Formula: - C4 Cl19 Cs2 Gd10 -
Comments: Liess, H.; Steffen, F.; Meyer, G. Qauternary chlorides and bromides with interstitially stabilized double octahedra, A2 (Gd10 (C2)2) Cl19 (A= Rb, Cs), A2 (Gd10 (C2)2) Br10 (A= K, Rb), Rb2 (Tb10 (C2)2) Br19, and K2 (Gd10 (C2)2) Br20 Journal of Alloys Compd. 246 (1997) 242-247
Space group: P b c n
Cell volume: 3855.91
Cell parameters: 12.344; 22.434; 13.924; 90; 90; 90;

COD ID: 1540848
CIF file	Formula: - Fe Nb1.54 O6 Ta0.46 - Comments: Wenger, M.; Armbruster, T. Columbite (Fe,Mn)(Nb,Ta)2O6 in the pegmatites of the calc-alkine Bergell intrusion (southeast Central Alps) Schweizerische Mineralogische und Petrographische Mitteilungen 71 (1991) 349-369 Space group: P b c n Cell volume: 416.404 Cell parameters: 14.317; 5.74; 5.067; 90; 90; 90;

COD ID: 1540849
CIF file	Formula: - Na3 P11 - Comments: Wichelhaus, W.; von Schnering, H.G. Na3 P11, ein Phosphid mit isolierten (P11)(3-) - Gruppen Naturwissenschaften 60 (1973) 104-104 Space group: P b c n Cell volume: 1275.39 Cell parameters: 9.828; 12.466; 10.41; 90; 90; 90;

COD ID: 1541634
CIF file	Formula: - H22 Mo5 N4 O24 S2 - Comments: Matsumoto, Kazuko Y.; Kato, Masao; Sasaki, Yukiyoshi The Crystal Structure of Ammonium Pentamolybdodisulfate(IV) (4-) Trihydrate (NH~4~)~4~[S^IV^2Mo~5~O~21~]·3H~2~O Bulletin of the Chemical Society of Japan 49(1) (1976) 106-110 Space group: P b c n Cell volume: 4792.11 Cell parameters: 15.096; 13.375; 23.734; 90; 90; 90;

COD ID: 1541755
CIF file	Formula: - C2 F6 K N O4 S2 - Comments: Xue, L.-X.; Padgett, C.W.; DesMarteau, D.D.; Pennington, W.T. Synthesis and structures of alkali metal salts of bis((trifluoromethyl) sulfonyl) imide Solid State Sciences 4 (2002) 1535-1545 Space group: P b c n Cell volume: 3891.27 Cell parameters: 22.346; 13.541; 12.86; 90; 90; 90;

COD ID: 1542162
CIF file	Formula: - C4 Cu Hg N4 S4 - Comments: Porai-Koshits, M.A. Structural Features of Crystals of Some Rhodanide Compounds with Divalent Nickel and Copper Zhurnal Strukturnoi Khimii (Issue-No. from 1981) 4 (1963) 584-593 Space group: P b c n Cell volume: 1050.66 Cell parameters: 9.03; 7.68; 15.15; 90; 90; 90;

COD ID: 1542263

Formula: - C24.5 H17 Cl N O S0.5 -
Comments: Xu, Bingjia; Mu, Yingxiao; Mao, Zhu; Xie, Zongliang; Wu, Haozhong; Zhang, Yi; Jin, Chongjun; Chi, Zhenguo; Liu, Siwei; Xu, Jiarui; Wu, Yuan-Chun; Lu, Po-Yen; Lien, Alan; Bryce, Martin R. Achieving remarkable mechanochromism and white-light emission with thermally activated delayed fluorescence through the molecular heredity principle Chem. Sci. 7(3) (2016) 2201
Space group: P b c n
Cell volume: 3808.54
Cell parameters: 15.9195; 13.7674; 17.3771; 90; 90; 90;

COD ID: 1542387
CIF file	Formula: - C10 H16 N4 O5 - Comments: Zheng, Jing; Qi, Jifeng; Cui, Sunliang Fe-Catalyzed Olefin Hydroamination with Diazo Compounds for Hydrazone Synthesis. Organic letters 18(1) (2016) 128-131 Space group: P b c n Cell volume: 2570.3 Cell parameters: 14.614; 12.706; 13.842; 90; 90; 90;

COD ID: 1542463

Formula: - C48 H40 Mo4 O16 P4 -
Comments: Mota Merelo de Aguiar, Sara Raquel; Stöger, Berthold; Weil, Matthias; Kirchner, Karl Tetrakis(μ~2~-diphenylphosphinato-κ^2^O,O')tetra-μ~3~-oxido-tetraoxidohexamolybdenum(V) IUCrData 1(1) (2016) x160036
Space group: P b c n
Cell volume: 4886.9
Cell parameters: 16.1061; 19.891; 15.254; 90; 90; 90;

COD ID: 1542544

Formula: - C12 H17 F9 N6 O7 -
Comments: Zhou, Dong-Dong; Xu, Yan-Tong; Lin, Rui-Biao; Mo, Zong-Wen; Zhang, Wei-Xiong; Zhang, Jie-Peng High-symmetry hydrogen-bonded organic frameworks: air separation and crystal-to-crystal structural transformation. Chemical communications (Cambridge, England) 52(28) (2016) 4991-4994
Space group: P b c n
Cell volume: 2048.4
Cell parameters: 12.335; 21.047; 7.89; 90; 90; 90;

COD ID: 1542568

Formula: - C38 H30 N4 S3 -
Comments: Zhang, Jing; Gu, Peiyang; Long, Guankui; Ganguly, Rakesh; Li, Yongxin; Aratani, Naoki; Yamada, Hiroko; Zhang, Qichun Switching charge-transfer characteristics from p-type to n-type through molecular “doping” (co-crystallization) Chem. Sci. 7(6) (2016) 3851
Space group: P b c n
Cell volume: 6020.6
Cell parameters: 29.6046; 11.8388; 17.1781; 90; 90; 90;

COD ID: 1542592

Formula: - C64.5 H68 Cl7.5 N5 Ni O2 -
Comments: Fukui, Norihito; Lee, Seung-Kyu; Kato, Kenichi; Shimizu, Daiki; Tanaka, Takayuki; Lee, Sangsu; Yorimitsu, Hideki; Kim, Dongho; Osuka, Atsuhiro Regioselective phenylene-fusion reactions of Ni(ii)-porphyrins controlled by an electron-withdrawing meso-substituent Chem. Sci. 7(7) (2016) 4059
Space group: P b c n
Cell volume: 12802
Cell parameters: 11.0983; 34.992; 32.965; 90; 90; 90;

COD ID: 1542892

Formula: - C22 H28 Br2 Cl Fe N4 O6 -
Comments: Vicente, Ana I.; Joseph, Abhinav; Ferreira, Liliana P.; de Deus Carvalho, Maria; Rodrigues, Vítor H. N.; Duttine, Mathieu; Diogo, Hermínio P.; Minas da Piedade, Manuel E.; Calhorda, Maria José; Martinho, Paulo N. Dynamic spin interchange in a tridentate Fe(iii) Schiff-base compound Chem. Sci. 7(7) (2016) 4251
Space group: P b c n
Cell volume: 2669.18
Cell parameters: 10.3027; 14.2644; 18.1624; 90; 90; 90;

COD ID: 1542893

Formula: - C22 H28 Br2 Cl Fe N4 O6 -
Comments: Vicente, Ana I.; Joseph, Abhinav; Ferreira, Liliana P.; de Deus Carvalho, Maria; Rodrigues, Vítor H. N.; Duttine, Mathieu; Diogo, Hermínio P.; Minas da Piedade, Manuel E.; Calhorda, Maria José; Martinho, Paulo N. Dynamic spin interchange in a tridentate Fe(iii) Schiff-base compound Chem. Sci. 7(7) (2016) 4251
Space group: P b c n
Cell volume: 2782.9
Cell parameters: 11.931; 12.17; 19.166; 90; 90; 90;

COD ID: 1543669

Formula: - C30 H22 B2 N2 -
Comments: Zhang, Wanzheng; Zhang, Fan; Tang, Ruizhi; Fu, Yubin; Wang, Xinyang; Zhuang, Xiaodong; He, Gufeng; Feng, Xinliang Angular BN-Heteroacenes with syn-Structure-Induced Promising Properties as Host Materials of Blue Organic Light-Emitting Diodes. Organic letters 18(15) (2016) 3618-3621
Space group: P b c n
Cell volume: 2235.24
Cell parameters: 28.5686; 10.069; 7.7705; 90; 90; 90;

COD ID: 1543783
CIF file	Formula: - C17 H36 Cl2 N6 Ni P2 - Comments: Mastalir, Matthias; Stöger, Berthold; Pittenauer, Ernst; Allmaier, Günter; Kirchner, Karl Air-Stable Triazine-Based Ni(II) PNP Pincer Complexes As Catalysts for the Suzuki-Miyaura Cross-Coupling. Organic letters 18(13) (2016) 3186-3189 Space group: P b c n Cell volume: 5482.1 Cell parameters: 18.1927; 14.0509; 21.446; 90; 90; 90;

COD ID: 1543809
CIF file	Formula: - C40 H42 O2 S8 - Comments: Khadem, Mohammadreza; Walsh, Joshua C.; Bodwell, Graham J.; Zhao, Yuming A Macrocyclization of 1,8-Bis(dithiafulvenyl)pyrenes. Organic letters 18(10) (2016) 2403-2406 Space group: P b c n Cell volume: 3992.7 Cell parameters: 4.4192; 33.029; 27.3541; 90; 90; 90;

COD ID: 1543884

Formula: - C9 H24 B4 O8 -
Comments: Liu, Sumeng; Girolami, Gregory S. Tetrakis(dimethoxyboryl)methane IUCrData 1(8) (2016) x161264
Space group: P b c n
Cell volume: 1655.34
Cell parameters: 7.5362; 15.1084; 14.5384; 90; 90; 90;

COD ID: 1543950

Formula: - C6 H12 Cd Cu O12 -
Comments: V.S. Dhanya; M.R. Sudarsanakumar; S. Suma; M.R. Prathapachandra Kurup; Maheswaran Sithambaresan; Sunalya M. Roy; Shibu M. Eapen Spectral, thermal, structural and microhardness studies of tetraaquabis(malonato)cadmium(II)copper(II): A new three-dimensional heterobimetallic framework system Inorganica Chimica Acta 409B (2014) 367-371
Space group: P b c n
Cell volume: 1207.08
Cell parameters: 6.6224; 13.9772; 13.0407; 90; 90; 90;

COD ID: 1543991
CIF file	Formula: - C44 H28 O4 - Comments: Zhu, Hai-Tao; Ke, Sen; Zhou, Ni-Ni; Fan, Ming-Jin; Yang, De-Suo Regioselective Intermolecular [2 + 2]-Cycloaddition of α-Iodo-Unsaturated Ketones Promoted by Diisobutylaluminum Hydride. Organic letters 18(18) (2016) 4554-4557 Space group: P b c n Cell volume: 3250.4 Cell parameters: 7.9399; 20.8101; 19.6719; 90; 90; 90;

COD ID: 1544136
CIF file	Formula: - C45 H38 N2 O4 - Comments: He, Benzhao; Zhen, Shijie; Wu, Yongwei; Hu, Rongrong; Zhao, Zujin; Qin, Anjun; Tang, Ben Zhong Cu(i)-Catalyzed amino-yne click polymerization Polym. Chem. 7(48) (2016) 7375 Space group: P b c n Cell volume: 3752.3 Cell parameters: 12.0454; 19.9342; 15.6271; 90; 90; 90;

COD ID: 1544267

Formula: - C17 H24 Cl2 Co N4 -
Comments: Wang, Feng; Cao, Bei; To, Wai-Pong; Tse, Chun-Wai; Li, Kai; Chang, Xiao-Yong; Zang, Chao; Chan, Sharon Lai-Fung; Che, Chi-Ming The effects of chelating N4ligand coordination on Co(ii)-catalysed photochemical conversion of CO2to CO: reaction mechanism and DFT calculations Catal. Sci. Technol. 6(20) (2016) 7408
Space group: P b c n
Cell volume: 1805.2
Cell parameters: 14.2357; 8.2893; 15.2974; 90; 90; 90;

COD ID: 1545105

Formula: - C30 H49 B5 Cl Ir3 -
Comments: Borthakur, Rosmita; Kar, Sourav; Barik, Subrat Kumar; Bhattacharya, Somnath; Kundu, Gargi; Varghese, Babu; Ghosh, Sundargopal Synthesis, Chemistry, and Electronic Structures of Group 9 Metallaboranes. Inorganic chemistry 56(3) (2017) 1524-1533
Space group: P b c n
Cell volume: 6740.9
Cell parameters: 18.0776; 23.0282; 16.1926; 90; 90; 90;

COD ID: 1545119

Formula: - C132 H242 Au34 S22 -
Comments: Dong, Hongwei; Liao, Lingwen; Zhuang, Shengli; Yao, Chuanhao; Chen, Jishi; Tian, Shubo; Zhu, Min; Liu, Xu; Li, Lingling; Wu, Zhikun A novel double-helical-kernel evolution pattern of gold nanoclusters: alternate single-stranded growth at both ends. Nanoscale 9(11) (2017) 3742-3746
Space group: P b c n
Cell volume: 20743.1
Cell parameters: 26.0266; 27.9405; 28.5247; 90; 90; 90;

COD ID: 1545184
CIF file	Formula: - C19 H21 N2 Np - Comments: Dutkiewicz, Michał S.; Apostolidis, Christos; Walter, Olaf; Arnold, Polly L. Reduction chemistry of neptunium cyclopentadienide complexes: from structure to understanding Chem. Sci. 8(4) (2017) 2553 Space group: P b c n Cell volume: 1683.5 Cell parameters: 13.6966; 8.3864; 14.6562; 90; 90; 90;

COD ID: 1545373

Formula: - C28 H18 B2 F4 N2 O2 -
Comments: Crandall, Laura A.; Dawadi, Mahesh B.; Burrell, Tailon; Odoom, Adwoa; Ziegler, Christopher J. Structure and electronics in dimeric boron π expanded azine and salphen complexes. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology (2017)
Space group: P b c n
Cell volume: 2218.8
Cell parameters: 10.5217; 12.6033; 16.7317; 90; 90; 90;

COD ID: 1545542
CIF file	Formula: - Mg O3 Si - Comments: Sadanaga, R.; Okamura, F.P.; Takeda, H. X-ray study of the phase transformations of enstatite :Sample at 1100 C Mineralogical Journal 6 (1969) 110-130 Space group: P b c n Cell volume: 440 Cell parameters: 9.34; 8.79; 5.36; 90; 90; 90;

COD ID: 1546309
CIF file	Formula: - C59 H64 Cl0 Cu N2 O2 S6 - Comments: Nguyen, Minh T.; Jones, Richard A.; Holliday, Bradley Effect of Conjugation Length and Metal-Backbone Interactions on Charge Transport Properties of Conducting Metallopolymers Polym. Chem. (2017) Space group: P b c n Cell volume: 5798 Cell parameters: 29.325; 20.484; 9.653; 90; 90; 90;

COD ID: 1546406

Formula: - C45 H38 -
Comments: Ou, Chang-Jin; Ding, Xue-Hua; Li, Yin-Xiang; Zhu, Can; Yu, Meng-Na; Xie, Ling-Hai; Lin, Jin-Yi; Xu, Chun-Xiang; Huang, Wei Conformational Effect of Polymorphic Terfluorene on Photophysics, Crystal Morphologies, and Lasing Behaviors The Journal of Physical Chemistry C 121(27) (2017) 14803
Space group: P b c n
Cell volume: 3256
Cell parameters: 8.6787; 23.1736; 16.1895; 90; 90; 90;

COD ID: 1546455
CIF file	Formula: - C20 H30 B Cl2 N4 P - Comments: Böser, Richard; Haufe, Lisa Cathrin; Freytag, Matthias; Jones, P. G.; Hörner, Gerald; René, Frank Completing the series of boron-nucleophilic cyanoborates: Boryl anions of type (NHC)−B(CN)2− Chem. Sci. (2017) Space group: P b c n Cell volume: 4623.8 Cell parameters: 31.987; 8.6554; 16.7007; 90; 90; 90;

COD ID: 1546511

Formula: - C10 H25 F2 Ga5 N4 O17 P4 -
Comments: Wessels, T.; McCusker, L. B.; Baerlocher, Ch.; Reinert, P.; Patarin, J. Synthesis, characterization and structure determination of a new fluorogallophosphate (Mu-5) prepared in the presence of 1,4,8,11-tetraazacyclotetradecane Microporous and Mesoporous Materials 23 (1998) 67-77
Space group: P b c n
Cell volume: 2589.7
Cell parameters: 13.372; 10.447; 18.538; 90; 90; 90;

COD ID: 1546972

Formula: - C91 H131.5 Dy K O13 -
Comments: Fieser, Megan E.; Palumbo, Chad T.; La Pierre, Henry Storms; Halter, Dominik P.; Voora, Vamsee K.; Ziller, Joseph W.; Furche, Filipp; Meyer, Karsten; Evans, William J. Comparisons of Lanthanide / Actinide +2 Ions in a Tris(aryloxide)arene Coordination Environment Chem. Sci. (2017)
Space group: P b c n
Cell volume: 16932.8
Cell parameters: 21.7362; 30.613; 25.4472; 90; 90; 90;

COD ID: 1547166
CIF file	Formula: - C46 H31 Cl4 N O2 - Comments: Shoyama, Kazutaka; Schmidt, David; Mahl, Magnus; Würthner, Frank Electron-Poor Bowl-Shaped Polycyclic Aromatic Dicarboximides: Synthesis, Crystal Structures, and Optical and Redox Properties. Organic letters 19(19) (2017) 5328-5331 Space group: P b c n Cell volume: 7168.8 Cell parameters: 24.3391; 8.299; 35.4906; 90; 90; 90;

COD ID: 1547190

Formula: - C22 H17 Cl2 N5 O5 -
Comments: Hamada Mohamed Ibrahim; Haider Behbehani; Mohamed H Elnagdi Approaches towards the synthesis of a novel class of 2-amino-5-arylazonicotinate, pyridazinone and pyrido[2,3-d]pyrimidine derivatives as potent antimicrobial agents Chemistry Central Journal 7 (2013) 123
Space group: P b c n
Cell volume: 4606.8
Cell parameters: 26.252; 7.3051; 24.0223; 90; 90; 90;

COD ID: 1547258
CIF file	Formula: - C24 H24 O7 - Comments: Petra Galer; Amalija Golobic; Joze Koller; Berta Kosmrlj; Boris Sket Structures in solid state and solution of dimethoxy curcuminoids: regioselective bromination and chlorination Chemistry Central Journal 7 (2013) 107 Space group: P b c n Cell volume: 2278 Cell parameters: 30.699; 8.444; 8.788; 90; 90; 90;

COD ID: 1547306
CIF file	Formula: - C10 H8 O2 - Comments: Stefan, Mihaela Corina; Du, Jia; Bulumulla, Chandima; Mejia, Israel; McCandless, Gregory T.; Biewer, Michael C. Evaluation of (E)-1,2-di(furan-2-yl)ethene as building unit in diketopyrrolopyrrole alternating copolymers for transistors Polym. Chem. (2017) Space group: P b c n Cell volume: 792.6 Cell parameters: 9.49; 11.322; 7.377; 90; 90; 90;

COD ID: 1547577
CIF file	Formula: - C37 H26 O2 S - Comments: Wang, Ming; Chen, Shihao; Jiang, Xuefeng Construction of Functionalized Annulated Sulfone via SO2/I Exchange of Cyclic Diaryliodonium Salts. Organic letters 19(18) (2017) 4916-4919 Space group: P b c n Cell volume: 6037.4 Cell parameters: 13.7489; 12.7062; 34.5595; 90; 90; 90;

COD ID: 1547651

Formula: - C6 H6 B I O2 -
Comments: Chai, Zhaofei; Wang, Can; Wang, Jinfeng; Liu, Fan; Xie, Yujun; Zhang, Yongzheng; Li, Jian-Rong Jeff; Li, Qianqian; Li, Zhen Abnormal Room Temperature Phosphorescence of Purely Organic Boron-Containing Compounds: the Relationship between the Emissive Behavior and the Molecular Packing, and the Potential Related Applications Chem. Sci. (2017)
Space group: P b c n
Cell volume: 3532.2
Cell parameters: 19.531; 18.4544; 9.7999; 90; 90; 90;

COD ID: 1548266
CIF file	Formula: - C22 H26 B2 N2 O2 - Comments: Di Wu; Lingbing Kong; Yongxin Li; Rakesh Ganguly; Rei Kinjo 1,3,2,5-Diazadiborinine featuring nucleophilic and electrophilic boron centres Nature Communications 6 (2015) 7340 Space group: P b c n Cell volume: 1963.2 Cell parameters: 9.3775; 22.196; 9.432; 90; 90; 90;

COD ID: 1548273

Formula: - C9 H5 Cu N5 O4 -
Comments: Tong-Liang Hu; Hailong Wang; Bin Li; Rajamani Krishna; Hui Wu; Wei Zhou; Yunfeng Zhao; Yu Han; Xue Wang; Weidong Zhu; Zizhu Yao; Shengchang Xiang; Banglin Chen Microporous metal-organic framework with dual functionalities for highly efficient removal of acetylene from ethylene/acetylene mixtures Nature Communications 6 (2015) 7328
Space group: P b c n
Cell volume: 3601.2
Cell parameters: 12.1905; 14.4177; 20.4894; 90; 90; 90;

COD ID: 1548494
CIF file	Formula: - C4 H4 Br4 O4 Pb3 - Comments: Peng, Chengdong; Zhuang, Zewen; Yang, Huimin; Zhang, Guiyang; Fei, Honghan Ultrastable, cationic three-dimensional lead bromide frameworks that intrinsically emit broadband white-light. Chemical science 9(6) (2018) 1627-1633 Space group: P b c n Cell volume: 1298.56 Cell parameters: 8.2193; 14.718; 10.7344; 90; 90; 90;

COD ID: 1548549
CIF file	Formula: - Mg O3 Si - Comments: Kanzaki, M.; Xue, X. Protoenstatite in MgSiO3 samples prepared by conventional solid state reaction Journal of Mineralogical and Petrological Sciences 112 (2017) 359-364 Space group: P b c n Cell volume: 430.311 Cell parameters: 9.25655; 8.73919; 5.31939; 90; 90; 90;

COD ID: 1548550
CIF file	Formula: - Mg O3 Si - Comments: Kanzaki, M.; Xue, X. Protoenstatite in MgSiO3 samples prepared by conventional solid state reaction : DFT optimized structure (0 K) Journal of Mineralogical and Petrological Sciences 112 (2017) 359-364 Space group: P b c n Cell volume: 430.651 Cell parameters: 9.2732; 8.7266; 5.3217; 90; 90; 90;

COD ID: 1548575
CIF file	Formula: - C18 H6 B3 F9 O3 - Comments: Arkhipenko, Sergey; Sabatini, Marco T.; Batsanov, Andrei S.; Karaluka, Valerija; Sheppard, Tom D.; Rzepa, Henry S.; Whiting, Andrew Mechanistic insights into boron-catalysed direct amidation reactions. Chemical science 9(4) (2018) 1058-1072 Space group: P b c n Cell volume: 1787.1 Cell parameters: 17.083; 13.093; 7.99; 90; 90; 90;

COD ID: 1548841

Formula: - C24 H26 O4 -
Comments: Kalaivanan, R.; Sughanya, V.; Sureshbabu, N. 9-(4-Formylphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione IUCrData 3(1) (2018) x180105
Space group: P b c n
Cell volume: 4024.7
Cell parameters: 15.1185; 11.0273; 24.141; 90; 90; 90;

COD ID: 1549169

Formula: - C22 H22.5 N2.5 O4 Zn -
Comments: Zorina-Tikhonova, Ekaterina N.; Chistyakov, Aleksandr S.; Kiskin, Mikhail A.; Sidorov, Aleksei A.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Voronova, Eugenia D.; Godovikov, Ivan A.; Korlyukov, Alexander A.; Eremenko, Igor L.; Vologzhanina, Anna V. Exploitation of knowledge databases in the synthesis of zinc(II) malonates with photo-sensitive and photo-insensitive N,N'-containing linkers IUCrJ 5(3) (2018)
Space group: P b c n
Cell volume: 4762
Cell parameters: 9.845; 22.082; 21.905; 90; 90; 90;

COD ID: 1549564
CIF file	Formula: - C23 H30 N2 - Comments: Walther, Patrick; Frey, Wolfgang; Naumann, Stefan Polarized olefins as enabling (co)catalysts for the polymerization of γ-butyrolactone Polymer Chemistry 9(26) (2018) 3674 Space group: P b c n Cell volume: 1959.9 Cell parameters: 15.5646; 7.8895; 15.9608; 90; 90; 90;

COD ID: 1549580

Formula: - C24 H16 F6 I2 N2 O6 S2 -
Comments: Riel, Asia Marie S.; Decato, Daniel A.; Sun, Jiyu; Massena, Casey J.; Jessop, Morly J.; Berryman, Orion B. The intramolecular hydrogen bonded-halogen bond: a new strategy for preorganization and enhanced binding. Chemical science 9(26) (2018) 5828-5836
Space group: P b c n
Cell volume: 3103.3
Cell parameters: 22.337; 12.7364; 10.9081; 90; 90; 90;

COD ID: 1549781

Formula: - C19 H14 O2 -
Comments: Devassia, Tomson; Mathew, Eason M.; Sithambaresan, M.; Unnikrishnan, P. A.; Kurup, M. R. Prathapachandra 10-Methyl-9,11-annulated dibenzobarrelene IUCrData 3(8) (2018) x181102
Space group: P b c n
Cell volume: 2773.4
Cell parameters: 19.7403; 9.3294; 15.0595; 90; 90; 90;

COD ID: 1549901

Formula: - Nb0.5 O2 Ti0.25 Zn0.25 -
Comments: Kumada, N.; Nakanome, K.; Yanagida, S.; Takei, T.; Fujii, I.; Wada, S.; Moriyoshi, C.; Kuroiwa, Y. Crystal structure, photocatalytic and dielectric property of ATiM2O8 (A: Mg, Zn; M: Nb, Ta) Journal of Asian Ceramic Societies 6 (2018) 247-253
Space group: P b c n
Cell volume: 132.377
Cell parameters: 4.67138; 5.65916; 5.00745; 90; 90; 90;

COD ID: 1550268

Formula: - C4 H5 Cu I N -
Comments: Wang, Rong-Yan; Zhang, Xiao; Yu, Jie-Hui; Xu, Ji-Qing Copper(i)-polymers and their photoluminescence thermochromism properties. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 18(2) (2019) 477-486
Space group: P b c n
Cell volume: 1172.04
Cell parameters: 4.2749; 16.1161; 17.0121; 90; 90; 90;

COD ID: 1550777
CIF file	Formula: - C34 H20.25 N6 O0.12 S4 - Comments: Li, Mengqi; Chen, Li-Jun; Zhang, Zhipeng; Luo, Qianfu; Yang, Hai-Bo; Tian, He; Zhu, Weihong Conformer-dependent self-assembly metallacycles with photo-reversible response Chemical Science (2019) Space group: P b c n Cell volume: 5931.9 Cell parameters: 32.3746; 8.0807; 22.6746; 90; 90; 90;

COD ID: 1550862

Formula: - C14 H18 Ca N2 O7 -
Comments: Al-Terkawi, Abdal-Azim; Scholz, Gudrun; Prinz, Carsten; Emmerling, Franziska; Kemnitz, Erhard Ca-, Sr-, and Ba-Coordination polymers based on anthranilic acid via mechanochemistry. Dalton transactions (Cambridge, England : 2003) 48(19) (2019) 6513-6521
Space group: P b c n
Cell volume: 1652.17
Cell parameters: 28.4326; 7.33162; 7.92571; 90; 90; 90;

COD ID: 1550864

Formula: - C14 H14 Ba N2 O5 -
Comments: Al-Terkawi, Abdal-Azim; Scholz, Gudrun; Prinz, Carsten; Emmerling, Franziska; Kemnitz, Erhard Ca-, Sr-, and Ba-Coordination polymers based on anthranilic acid via mechanochemistry. Dalton transactions (Cambridge, England : 2003) 48(19) (2019) 6513-6521
Space group: P b c n
Cell volume: 2952.23
Cell parameters: 31.0208; 12.1669; 7.822; 90; 90; 90;

COD ID: 1551305
CIF file	Formula: - C42 H68 N4 O6 S2 - Comments: M.Mir, Fatemeh; Crisma, Marco; Toniolo, Claudio; Lubell, William D. Isolated α-turn and incipient γ-helix Chemical Science (2019) Space group: P b c n Cell volume: 16531.8 Cell parameters: 9.8603; 43.035; 38.9591; 90; 90; 90;

COD ID: 1551517

Formula: - C38 H58 N14 S4 Zn2 -
Comments: Yu, Ping; Deng, Jungang; Cai, Jinhua; Zhang, Zhenlei; Zhang, Juzheng; Hamid Khan, Muhammad; Liang, Hong; Yang, Feng Anticancer and biological properties of a Zn-2,6-diacetylpyridine bis(thiosemicarbazone) complex. Metallomics : integrated biometal science 11(8) (2019) 1372-1386
Space group: P b c n
Cell volume: 4739
Cell parameters: 20.581; 13.879; 16.592; 90; 90; 90;

COD ID: 1551632
CIF file	Formula: - C25 H28 Cu N6 O6 - Comments: SAGA, Makoto; SAKANE, Genta; YAMAZAKI, Shigeo; SAITO, Keiitsu Crystal Structure of a Copper(II) Complex with <i>N</i>,<i>N</i>′-Bis(2-methylquinolyl)-dimethyl-1,3-propanediamine X-ray Structure Analysis Online 31 (2015) 41 Space group: P b c n Cell volume: 2428.6 Cell parameters: 12.666; 12.687; 15.113; 90; 90; 90;

COD ID: 1551650
CIF file	Formula: - C19 H14 N4 O - Comments: HAO, Yongjing; XIE, Juan; MENG, Xiaocai; GAO, Xiaorui Crystal Structure of 1,3-Di(quinolin-3-yl)urea X-ray Structure Analysis Online 30 (2014) 27 Space group: P b c n Cell volume: 1543.8 Cell parameters: 7.9513; 23.364; 8.3103; 90; 90; 90;

COD ID: 1551726
CIF file	Formula: - C19 H20 N2 S - Comments: SRINIVASAN, N.; THIRUMARAN, S.; KAPOOR, Kamini; GUPTA, Vivek K. Crystal Structure of Bis(3,4-dihydroisoquinolin-2(1H)-yl)methanethione X-ray Structure Analysis Online 27 (2011) 63 Space group: P b c n Cell volume: 1604.42 Cell parameters: 4.8145; 12.6749; 26.2919; 90; 90; 90;

COD ID: 1551779
CIF file	Formula: - C9 H10 Cl3 N3 O - Comments: KAWAMURA, Tomoko; HIRAYAMA, Noriaki Addendum: Crystal Structure of Guanfacine Hydrochloride [X-ray Structure Analysis Online, Vol. 25, p. 3 (2009)] X-ray Structure Analysis Online 25 (2009) 47 Space group: P b c n Cell volume: 4790.5 Cell parameters: 14.439; 8.3664; 39.656; 90; 90; 90;

COD ID: 1552117

Formula: - C32 H22 F12 N4 O2 -
Comments: Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Askerova, Ulviyya F.; Mukhtarova, Sevinc H.; Mammadova, Gunay Z.; Toze, Flavien A. A. (1Z,2Z)-1,2-Bis(2-(3,5-bis(trifluoromethyl)phenyl)hydrazineylidene)-1,2-bis(4-methoxyphenyl)ethane including an unknown solvate IUCrData 4(7) (2019) x191010
Space group: P b c n
Cell volume: 3408.5
Cell parameters: 13.479; 11.213; 22.552; 90; 90; 90;

COD ID: 1552157
CIF file	Formula: - C17 H22 O - Comments: Stegbauer, Simone; Jeremias, Noah; Jandl, Christian; Bach, Thorsten Reversal of reaction type selectivity by Lewis acid coordination: the ortho photocycloaddition of 1- and 2-naphthaldehyde Chemical Science (2019) Space group: P b c n Cell volume: 2767.96 Cell parameters: 31.0922; 11.7199; 7.596; 90; 90; 90;

COD ID: 1552496
CIF file	Formula: - C44 H24 In N2 O8 - Comments: Jiang, Xiao-Lei; Hou, Sheng-Li; Jiao, Zhuo-Hao; Zhao, Bin Luminescent Detection of Colchicine by a Unique Indium-Organic Framework in Water with High Sensitivity. Analytical chemistry 91(15) (2019) 9754-9759 Space group: P b c n Cell volume: 20008 Cell parameters: 29.078; 22.581; 30.471; 90; 90; 90;

COD ID: 1552882

Formula: - C42 H53 Au N2 -
Comments: Romanov, Alexander S.; Jones, Saul T. E.; Gu, Qinying; Conaghan, Patrick J.; Drummond, Bluebell H.; Feng, Jiale; Chotard, Florian; Buizza, Leonardo; Foley, Morgan; Linnolahti, Mikko; Credgington, Dan; Bochmann, Manfred Carbene metal amide photoemitters: tailoring conformationally flexible amides for full color range emissions including white-emitting OLED. Chemical science 11(2) (2020) 435-446
Space group: P b c n
Cell volume: 8157.8
Cell parameters: 34.2921; 13.9716; 17.0268; 90; 90; 90;

COD ID: 1552971
CIF file	Formula: - C31 H30 N2 - Comments: Wang, Bin; Gu, Zhenhua Highly efficient and practical resolution of 2,3:6,7-dibenzobicyclo[3.3.1]nona-2,6-diene-4,8-dione and stereoselective synthesis of its chiral diamine derivatives Org. Chem. Front. 1(3) (2014) 271 Space group: P b c n Cell volume: 2388.9 Cell parameters: 26.28; 9.4772; 9.5917; 90; 90; 90;

COD ID: 1553602
CIF file	Formula: - C12 H9 N O S3 - Comments: Chen, Qiao; Lei, Yingjie; Wang, Yanfang; Wang, Chao; Wang, Yanan; Xu, Zhaoqing; Wang, Huan; Wang, Rui Direct thiocyanation of ketene dithioacetals under transition-metal-free conditions Organic Chemistry Frontiers 4(3) (2017) 369 Space group: P b c n Cell volume: 2540.92 Cell parameters: 7.9629; 16.9905; 18.7808; 90; 90; 90;

COD ID: 1553910
CIF file	Formula: - C38 H26 N4 O4 - Comments: Zwoliński, K. M.; Sieroń, L.; Eilmes, J. One-flask synthesis of dibenzotetraaza[14]annulene cyclic congeners bearing buta-1,3-diyne bridges Organic Chemistry Frontiers 5(2) (2018) 171 Space group: P b c n Cell volume: 5865.1 Cell parameters: 21.1618; 11.9414; 23.2097; 90; 90; 90;

COD ID: 1554197
CIF file	Formula: - C56 H34 F12 Ir N5 O2 P2 - Comments: Han, Hua-Bo; Ma, Xiao-Feng; Wu, Zheng-Guang; Zheng, You-Xuan Highly efficient yellow electroluminescence of iridium complexes with good electron mobility Materials Chemistry Frontiers 2(7) (2018) 1284 Space group: P b c n Cell volume: 10298 Cell parameters: 22.853; 23.83; 18.909; 90; 90; 90;

COD ID: 1554328
CIF file	Formula: - C16 H15 Cl O - Comments: Chen, Mintao; Wei, Yin; Shi, Min A facile method for the synthesis of trifluoromethylthio-/chloro-homoallylic alcohols from methylenecyclopropanes Organic Chemistry Frontiers 5(13) (2018) 2030 Space group: P b c n Cell volume: 2690.46 Cell parameters: 57.5837; 5.8021; 8.0527; 90; 90; 90;

COD ID: 1554752
CIF file	Formula: - C64 H72 Cl2 N18 Na2 O19 S2 - Comments: Bauer, Daniel; Andrae, Beatrice; Gaß, Patrick; Trenz, Danjano; Becker, Sabine; Kubik, Stefan Functionalisable acyclic cucurbiturils Organic Chemistry Frontiers 6(10) (2019) 1555 Space group: P b c n Cell volume: 19272.1 Cell parameters: 19.1042; 43.808; 23.0275; 90; 90; 90;

COD ID: 1554942

Formula: - C26 H20 Cu F6 P -
Comments: Liu, He; Shen, Qilong Bistrifluoromethylated organocuprate [Ph4P]+[Cu(CF3)2]−: synthesis, characterization and its application for trifluoromethylation of activated heteroaryl bromides, chlorides and iodides Organic Chemistry Frontiers 6(14) (2019) 2324
Space group: P b c n
Cell volume: 2277.26
Cell parameters: 15.5529; 7.3629; 19.8862; 90; 90; 90;

COD ID: 1554985
CIF file	Formula: - C25 H22 B11 Cl6 N - Comments: Lu, Mengsi; Allemann, Oliver; Xu, Jun; Linden, Anthony; Baldridge, Kim K.; Siegel, Jay S. Peraryl-X-onium ions of nitrogen and oxygen Organic Chemistry Frontiers 6(15) (2019) 2640 Space group: P b c n Cell volume: 6352.02 Cell parameters: 18.70332; 18.4574; 18.4002; 90; 90; 90;

COD ID: 1554986
CIF file	Formula: - C25 H22 B11 Cl6 N - Comments: Lu, Mengsi; Allemann, Oliver; Xu, Jun; Linden, Anthony; Baldridge, Kim K.; Siegel, Jay S. Peraryl-X-onium ions of nitrogen and oxygen Organic Chemistry Frontiers 6(15) (2019) 2640 Space group: P b c n Cell volume: 6225.53 Cell parameters: 18.015; 14.8013; 23.3476; 90; 90; 90;

COD ID: 1555205
CIF file	Formula: - C25 H18 N2 O2 - Comments: Wössner, Jan S.; Grenz, David C.; Kratzert, Daniel; Esser, Birgit Tuning the optical properties of spiro-centered charge-transfer dyes by extending the donor or acceptor part Organic Chemistry Frontiers 6(21) (2019) 3649 Space group: P b c n Cell volume: 3616.1 Cell parameters: 18.714; 15.974; 12.0964; 90; 90; 90;

COD ID: 1555422
CIF file	Formula: - C16 H18 Li N2 O - Comments: Kornev, Alexander N.; Sushev, Vyacheslav V.; Zolotareva, Natalia V.; Baranov, Evgenii V.; Fukin, Georgy K.; Abakumov, Gleb A. Interaction of Azobenzene and Benzalaniline with Strong Amido Bases. Organic letters 17(24) (2015) 6154-6157 Space group: P b c n Cell volume: 1435.81 Cell parameters: 15.9311; 9.7436; 9.2498; 90; 90; 90;

COD ID: 1556086

Formula: - C148 H134 Ag10 B2 Cl8 F8 N6 P12 -
Comments: Ma, Howard Z.; McKay, Alasdair I.; Mravak, Antonija; Scholz, Michael S.; White, Jonathan M.; Mulder, Roger J.; Bieske, Evan J.; Bonačić-Koutecký, Vlasta; O'Hair, Richard A. J. Structural characterization and gas-phase studies of the [Ag10H8(L)6]2+ nanocluster dication Nanoscale (2019)
Space group: P b c n
Cell volume: 14711.4
Cell parameters: 28.1498; 17.1737; 30.4308; 90; 90; 90;

COD ID: 1556482
CIF file	Formula: - C12 H28 Br2 Ca O5 - Comments: Koch, A.; Krieck, S.; Gorls, H.; Westerhausen, M. Reduction of Bromo- and Iodo-2,6-bis(diphenylphosphanylmethyl)benzene with Magnesium and Calcium Inorganics 4 (2016) 39 Space group: P b c n Cell volume: 1879.04 Cell parameters: 11.4609; 11.5457; 14.2003; 90; 90; 90;

COD ID: 1556590
CIF file	Formula: - C29 H44 Cl F6 Ir N3 O1.5 P - Comments: Grotjahn, D.B.; Martin, J.K.; Tom, T.N.; Rheingold, A.L. Cationic Protic Imidazolylidene NHC Complexes of CpIrCl+ and CpRhCl+ with a Pyridyl Tether Formed at Ambient Temperature Inorganics 6 (2018) 27 Space group: P b c n Cell volume: 6465.4 Cell parameters: 11.9277; 19.21; 28.2172; 90; 90; 90;

COD ID: 1556592
CIF file	Formula: - C29 H44 Cl F6 N3 O1.5 P Rh - Comments: Grotjahn, D.B.; Martin, J.K.; Tom, T.N.; Rheingold, A.L. Cationic Protic Imidazolylidene NHC Complexes of CpIrCl+ and CpRhCl+ with a Pyridyl Tether Formed at Ambient Temperature Inorganics 6 (2018) 27 Space group: P b c n Cell volume: 6617.5 Cell parameters: 12.1218; 19.268; 28.333; 90; 90; 90;

COD ID: 1556593
CIF file	Formula: - C23 H30 N2 - Comments: Cybularczyk-Cecotka, M.; Dabrowska, A.M.; Gunka, P.A.; Horeglad, P. Probing the Effect of Six-Membered N-Heterocyclic Carbene-6-Mes-on the Synthesis, Structure and Reactivity of Me2MOR(NHC) (M = Ga, In) Complexes Inorganics 6 (2018) 28 Space group: P b c n Cell volume: 2014.7 Cell parameters: 15.7258; 7.9668; 16.0813; 90; 90; 90;

COD ID: 1556657
CIF file	Formula: - C24 H37 B Ru2 S6 - Comments: Saha, K.; Kaur, U.; Borthakur, R.; Ghosh, S. Synthesis of Trithia-Borinane Complexes Stabilized in Diruthenium Core: [(CpRu)2(n1-S)(n1-CS){(CH2)2S3BR}] (R = H or SMe) Inorganics 7 (2019) 21 Space group: P b c n Cell volume: 5799 Cell parameters*: 34.157; 8.5558; 19.8431; 90; 90; 90;

COD ID: 1556849