Crystallography Open Database

Result : There are 187 entries in the selection

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Searching space group like 'I 41 c d'

COD ID: 1100825
CIF file Formula: - C23 H35 Si Y -
Comments: Evans, William J.; Kozimor, Stosh A.; Brady, Jason C.; Davis, Benjamin L.; Nyce, Gregory W.; Seibel, Christopher A.; Ziller, Joseph W.; Doedens, Robert J. Metallocene Allyl Reactivity in the Presence of Alkenes Tethered to Cyclopentadienyl Ligands Organometallics 24(10) (2005) 2269-2278
Space group: I 41 c d
Cell volume: 8639.4
Cell parameters: 29.2318; 29.2318; 10.1105; 90; 90; 90;  

COD ID: 1100973
CIF file Formula: - Ge2 H20 N8 Se6 -
Comments: David B. Mitzi Synthesis, Structure, and Thermal Properties of Soluble Hydrazinium Germanium(IV) and Tin(IV) Selenide Salts Inorganic Chemistry 44 (2005) 3755-3761
Space group: I 41 c d
Cell volume: 3545.6
Cell parameters: 12.708; 12.708; 21.9553; 90; 90; 90;  

COD ID: 1505514
CIF file Formula: - C38 H24 -
Comments: Debroy, Paromita; Lindeman, Sergey V.; Rathore, Rajendra Hexabenzo[4.4.4]propellane: a helical molecular platform for the construction of electroactive materials. Organic letters 9(21) (2007) 4091-4094
Space group: I 41 c d
Cell volume: 9530.8
Cell parameters: 16.7363; 16.7363; 34.0261; 90; 90; 90;  

COD ID: 1508607
CIF file Formula: - C75 H76 Ag2 F22 N8 O7 S2 -
Comments: Habata, Yoichi; Ikeda, Mari; Yamada, Sachiko; Takahashi, Hiroki; Ueno, Sumiko; Suzuki, Takatoshi; Kuwahara, Shunsuke Argentivorous molecules: structural evidence for Ag(+)-π interactions in solution. Organic letters 14(17) (2012) 4576-4579
Space group: I 41 c d
Cell volume: 14815
Cell parameters: 19.454; 19.454; 39.146; 90; 90; 90;  

COD ID: 1511473
CIF file Formula: - B4 Li2 O7 -
Comments: Muradyan, L.A.; Malakhova, L.F.; Burak, Ya.V.; Simonov, V.I.; Radaev, S.F. Atomic structure and electron density of lithium tetraborate Li2 B4 O7 Kristallografiya 34 (1989) 1400-1407
Space group: I 41 c d
Cell volume: 924.571
Cell parameters: 9.479; 9.479; 10.29; 90; 90; 90;  

COD ID: 1520353
CIF file Formula: - C12 H17 N O -
Comments: Coles, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B. N-(2-tert-butylphenyl)acetamide Crystal Structure Report Archive (2009) 1369
Space group: I 41 c d
Cell volume: 4537.9
Cell parameters: 16.2982; 16.2982; 17.0833; 90; 90; 90;  

COD ID: 1530039
CIF file Formula: - Pr8 S15 Sb2 -
Comments: Guseinov, G.G.; Mamedov, F.Kh.; Mamedov, Kh.S.; Amiraslanov, I.R. The crystal structure of Pr8 Sb2 S15 Kristallografiya 26 (1981) 831-833
Space group: I 41 c d
Cell volume: 4800.17
Cell parameters: 15.626; 15.626; 19.659; 90; 90; 90;  

COD ID: 1532852
CIF file Formula: - Mg0.12 Ni1.88 O8 Pb V2 -
Comments: Mastoraki, I.; Lappas, A.; Toebbens, D.M.; Giapintzakis, J.; Hernandez-Velasco, J. Relations of crystal structure to magnetic properties in the quasi-one-dimensional compound Pb Ni1.88 Mg0.12 V2 O8 Journal of Solid State Chemistry 177 (2004) 2404-2414
Space group: I 41 c d
Cell volume: 1254.38
Cell parameters: 12.25008; 12.25008; 8.35891; 90; 90; 90;  

COD ID: 1549469
CIF file Formula: - C44 N4 Ni O22 P4 Zr2 -
Comments: Rhauderwiek, Timo; Zhao, Haishuang; Hirschle, Patrick; Döblinger, Markus; Bueken, Bart; Reinsch, Helge; De Vos, Dirk; Wuttke, Stefan; Kolb, Ute; Stock, Norbert Highly stable and porous porphyrin-based zirconium and hafnium phosphonates - electron crystallography as an important tool for structure elucidation. Chemical science 9(24) (2018) 5467-5478
Space group: I 41 c d
Cell volume: 15355
Cell parameters: 44.7776; 44.7776; 7.6581; 90; 90; 90;  

COD ID: 1550751
CIF file Formula: - C49 H63 Cl N2 Pd -
Comments: Du, Cheng; Zhong, Liu; Gao, Jie; Zhong, Shuhuang; Liao, Heng; Gao, Haiyang; Wu, Qing Living (co)polymerization of ethylene and bio-based furfuryl acrylate using dibenzobarrelene derived α-diimine palladium catalysts Polymer Chemistry 10(16) (2019) 2029
Space group: I 41 c d
Cell volume: 19060.1
Cell parameters: 24.7912; 24.7912; 31.0121; 90; 90; 90;  

COD ID: 1553938
CIF file Formula: - C27 H23 N3 O -
Comments: Zhang, Chen; Pi, Junxia; Chen, Shu; Liu, Ping; Sun, Peipei Construction of a 4H-pyrido[4,3,2-gh]phenanthridin-5(6H)-one skeleton via a catalyst-free radical cascade addition/cyclization using azo compounds as radical sources Organic Chemistry Frontiers 5(5) (2018) 793
Space group: I 41 c d
Cell volume: 8410
Cell parameters: 31.825; 31.825; 8.303; 90; 90; 90;  

COD ID: 1556041
CIF file Formula: - C19 H37 Br Cu N3 P2 -
Comments: Mastalir, Matthias; Pittenauer, Ernst; Stöger, Berthold; Allmaier, Günter; Kirchner, Karl Three Different Reactions, One Catalyst: A Cu(I) PNP Pincer Complex as Catalyst for C-C and C-N Cross-Couplings. Organic letters 19(8) (2017) 2178-2181
Space group: I 41 c d
Cell volume: 18761.4
Cell parameters: 31.5316; 31.5316; 18.8701; 90; 90; 90;  

COD ID: 1556596
CIF file Formula: - C38 H47 In N2 O -
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: I 41 c d
Cell volume: 15507.4
Cell parameters: 28.4159; 28.4159; 19.2051; 90; 90; 90;  

COD ID: 1558313
CIF file Formula: - C36 H29 B F2 N2 -
Comments: Labella, Jorge; Durán-Sampedro, Gonzalo; Martínez-Díaz, M. Victoria; Torres, Tomás Annulative π-extension of BODIPYs made easy via gold(i)-catalyzed cycloisomerization Chemical Science 11(39) (2020) 10778-10785
Space group: I 41 c d
Cell volume: 11378.2
Cell parameters: 17.6517; 17.6517; 36.5175; 90; 90; 90;  

COD ID: 1560442
CIF file Formula: - Ce8 S15 Sb2 -
Comments: Zhao, Hua-Jun; Zhong, Xiao-Ai Synthesis, crystal structure, and optical properties of the noncentrosymmetric sulfide Ce 8 Sb 2 S 15 Journal of Solid State Chemistry 251 (2017) 65-69
Space group: I 41 c d
Cell volume: 4934.6
Cell parameters: 15.7871; 15.7871; 19.7992; 90; 90; 90;  

COD ID: 1573160
CIF file Formula: - C84 H100 Ga2 N4 -
Comments: Merschel, Arne; Heda, Shkelqim; Vishnevskiy, Yury V.; Neumann, Beate; Stammler, Hans-Georg; Ghadwal, Rajendra S. Annulated carbocyclic gallylene and bis-gallylene with two-coordinated Ga(i) atoms. Chemical science 16(5) (2025) 2222-2230
Space group: I 41 c d
Cell volume: 14129.2
Cell parameters: 17.2516; 17.2516; 47.4743; 90; 90; 90;  

COD ID: 1574239
CIF file Formula: - C12 H12 Fe0.67 N8 Zn1.33 -
Comments: León-Alcaide, Luis; Castillo-Blas, Celia; Martin-Diaconescu, Vlad; da Silva, Ivan; Keen, David A.; Bennett, Thomas D.; Mínguez Espallargas, Guillermo Solvent-free approach for the synthesis of heterometallic Fe–Zn-ZIF glass via a melt-quenched process Chemical Science 16(18) (2025) 7946-7955
Space group: I 41 c d
Cell volume: 6892.7
Cell parameters: 23.4527; 23.4527; 12.5316; 90; 90; 90;  

COD ID: 2000531
CIF file

Original IUCr paper

Formula: - C11 H14 N2 O2 -
Comments: Maurin, J. K.; Paul, I. C.; Curtin, D. Y. Structure of (<i>E</i>)-4-benzoylbutyramide oxime Acta Crystallographica Section C 48(10) (1992) 1819-1821
Space group: I 41 c d
Cell volume: 4256
Cell parameters: 15.582; 15.582; 17.528; 90; 90; 90;  

COD ID: 2001596
CIF file

Original IUCr paper

Formula: - C51.5 H44 Cl2 Ir2 N4 -
Comments: Garces, F. O.; Dedeian, K.; Keder, N. L.; Watts, R. J. Structures of <i>ortho</i>-metalated [2-(<i>p</i>-tolyl)pyridine]iridium(III) complexes Acta Crystallographica Section C 49(6) (1993) 1117-1120
Space group: I 41 c d
Cell volume: 9514
Cell parameters: 16.9; 16.9; 33.31; 90; 90; 90;  

COD ID: 2002120
CIF file Formula: - Ni2 O8 Sr V2 -
Comments: Wichmann, R; Muller-Buschbaum, H Sr Ni2 V2 O8: Ein neuer Strukturtyp der ErdalkaliOxometallate Revue de Chimie Minerale 23 (1986) 1-7
Space group: I 41 c d
Cell volume: 1231.3
Cell parameters: 12.1617; 12.1617; 8.3247; 90; 90; 90;  

COD ID: 2002647
CIF file Formula: - Co2 O8 Sr V2 -
Comments: Osterloh, D; Mueller-Buschbaum, Hk Zur Kenntnis von Sr Co2 V2 O8 und Sr Co2 (As O4)2 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 49 (1994) 923-926
Space group: I 41 c d
Cell volume: 1267.6
Cell parameters: 12.267; 12.267; 8.424; 90; 90; 90;  

COD ID: 2002870
CIF file Formula: - As1.38 Ni2 O8 Sr V0.62 -
Comments: Mueller-Buschbaum, Hk; Scheske, St Oxometallate mit partiell salzartigem Anion: Die Kristallchemie von Ba Ni2 (M O4)(2-x) (V O4)x (M= As (x=0.67) und P (x=0.64)) und Sr Ni2 (As O4)(2-x) (V O4)x (x=0.62) Journal of the Less-Common Metals 171 (1991) 313-320
Space group: I 41 c d
Cell volume: 1216
Cell parameters: 12.1595; 12.1595; 8.2241; 90; 90; 90;  

COD ID: 2005770
CIF file

Original IUCr paper

Formula: - C4 H9 N O2 -
Comments: Dobson, A. J.; Gerkin, R. E. γ-Aminobutyric Acid: a Novel Tetragonal Phase Acta Crystallographica Section C 52(12) (1996) 3075-3078
Space group: I 41 c d
Cell volume: 2187.1
Cell parameters: 11.963; 11.963; 15.282; 90; 90; 90;  

COD ID: 2006898
CIF file

Original IUCr paper

Formula: - C42 H98 Er0.4 O15 Tb3.6 Ti -
Comments: Marat Moustiakimov; Mikael Kritikos; Gunnar Westin (Tb~0.9~,Er~0.1~)~4~TiO(O^<i>i^</i>Pr)~14~, a Novel Pentanuclear Oxo‒Alkoxide Acta Crystallographica Section C 54(1) (1998) 29-31
Space group: I 41 c d
Cell volume: 11821.7
Cell parameters: 21.4236; 21.4236; 25.757; 90; 90; 90;  

COD ID: 2007979
CIF file

Original IUCr paper

Formula: - C18 H16 Cl2 Cu N4 -
Comments: Małecka, Magdalena; Grabowski, Mieczysław J.; Olszak, Tomasz A.; Kostka, K.; Strawiak, M. Investigations of Complexes of Copper(II) Chloride with Phenylpyrazoles Acta Crystallographica Section C 54(12) (1998) 1770-1773
Space group: I 41 c d
Cell volume: 3641
Cell parameters: 14.795; 14.795; 16.634; 90; 90; 90;  

COD ID: 2009698
CIF file

Original IUCr paper

Formula: - C6 H12 Cl3 Fe S3 -
Comments: Ballester, Joanne; Parker, O. Jerry; Breneman, Gary L. Trichloro(1,4,7-trithiacyclononane-<i>S</i>,<i>S</i>',<i>S</i>'')iron(III), [FeCl~3~(C~6~H~12~S~3~)] Acta Crystallographica Section C 50(5) (1994) 712-714
Space group: I 41 c d
Cell volume: 4974.6
Cell parameters: 17.352; 17.352; 16.522; 90; 90; 90;  

COD ID: 2011906
CIF file

Original IUCr paper

Formula: - C23 H27 F O4 -
Comments: Bolte, Michael; Degen, Alexander; Rühl, Stephan Packing considerations of bis-dimedone derivatives Acta Crystallographica Section C 57(4) (2001) 446-451
Space group: I 41 c d
Cell volume: 16443
Cell parameters: 21.186; 21.186; 36.633; 90; 90; 90;  

COD ID: 2012311
CIF file

Original IUCr paper

Formula: - C36.5 H26 Mn2 O8 P2 -
Comments: Baxley, Gregory T.; Stiegman, Albert E.; Nieckarz, Gregory F.; Weakley, Timothy J. R.; Tyler, David R.; Gilbertson, John μ-Bis(diphenylphosphino)methane-<i>P</i>:<i>P</i>'-octacarbonyldimanganese(<i>Mn</i>‒<i>Mn</i>) and its toluene hemisolvate Acta Crystallographica Section C 57(11) (2001) 1292-1294
Space group: I 41 c d
Cell volume: 13825
Cell parameters: 18.286; 18.286; 41.345; 90; 90; 90;  

COD ID: 2013510
CIF file

HKL data

Original IUCr paper

Formula: - C18 H21 N O2 -
Comments: Thamotharan, S.; Parthasarathi, V.; Malik, R.; Jindal, D. P.; Piplani, P.; Linden, Anthony 2-(2-Naphthyloxy)acetate derivatives. I. A new class of antiamnesic agents Acta Crystallographica Section C 59(8) (2003) o422-o425
Space group: I 41 c d
Cell volume: 6104.55
Cell parameters: 20.9438; 20.9438; 13.9169; 90; 90; 90;  

COD ID: 2015313
CIF file

HKL data

Original IUCr paper

Formula: - C28 H38 N2 O10 P4 -
Comments: Courtney, Brandy H.; Juma, Booker W. O.; Watkins, Steven F.; Fronczek, Frank R.; Stanley, George G. Symmetric hydrogen bonding in dimethylammonium hydrogen diphenyldiphosphonate Acta Crystallographica Section C 62(5) (2006) o268-o270
Space group: I 41 c d
Cell volume: 6660
Cell parameters: 13.11; 13.11; 38.751; 90; 90; 90;  

COD ID: 2019290
CIF file

Original IUCr paper

Formula: - C27 H26 Cl2 I2 Ni P2 -
Comments: Schultz, Madeleine; Plessow, Philipp-Nikolaus; Rominger, Frank; Weigel, Laura Structure, magnetism and colour in simple bis(phosphine)nickel(II) dihalide complexes: an experimental and theoretical investigation Acta Crystallographica Section C 69(12) (2013) 1437-1447
Space group: I 41 c d
Cell volume: 11675.8
Cell parameters: 26.3705; 26.3705; 16.79; 90; 90; 90;  

COD ID: 2023071
CIF file

Original IUCr paper

Formula: - C18 H18 O12 -
Comments: Hanauer, Thomas; Seichter, Wilhelm; Mazik, Monika Crystal structure and Hirshfeld surface analysis of 4,4'-di-meth-oxy-biphenyl-3,3',5,5'-tetra-carb-oxy-lic acid dihydrate. Acta crystallographica. Section E, Crystallographic communications 80(Pt 4) (2024) 413-417
Space group: I 41 c d
Cell volume: 3734.7
Cell parameters: 24.069; 24.069; 6.4468; 90; 90; 90;  

COD ID: 2101422
CIF file

Original IUCr paper

Formula: - C12 H14 Fe O -
Comments: Glidewell, C.; Klar, R. B.; Lightfoot, P.; Zakaria, C. M.; Ferguson, G. Hydrogen bonding in α-ferrocenyl alcohols: structures of 1-ferrocenylethanol, 1-ferrocenyl-2-phenylethanol, 1-ferrocenyl-1-phenylpropan-1-ol, 1-ferrocenyl-1-phenyl-2-methylpropan-1-ol, 1-ferrocenyl-1-phenyl-2,2-dimethylpropan-1-ol, 1-ferrocenyl-1,2-diphenylethanol and diferrocenyl(phenyl)methanol Acta Crystallographica Section B 52(1) (1996) 110-121
Space group: I 41 c d
Cell volume: 4202.4
Cell parameters: 23.3334; 23.3334; 7.7186; 90; 90; 90;  

COD ID: 2101598
CIF file

Original IUCr paper

Formula: - Ni2 O8 Sr V2 -
Comments: Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B 52(5) (1996) 790-805
Space group: I 41 c d
Cell volume: 1231.3
Cell parameters: 12.1617; 12.1617; 8.3247; 90; 90; 90;  

COD ID: 2103750
CIF file

HKL data

Original IUCr paper

Formula: - C14 H6 Cu F12 N2 O4 -
Comments: Yasui, Masanori; Ishikawa, Yoshimitsu; Ishida, Takayuki; Nogami, Takashi; Iwasaki, Fujiko Bis(hfac)-copper(II) complexes bridged by pyrimidines showing magnetic interactions Acta Crystallographica Section B 57(6) (2001) 772-779
Space group: I 41 c d
Cell volume: 7718.8
Cell parameters: 18.586; 18.586; 22.345; 90; 90; 90;  

COD ID: 2103751
CIF file

HKL data

Original IUCr paper

Formula: - C14 H6 Cu F12 N2 O4 -
Comments: Yasui, Masanori; Ishikawa, Yoshimitsu; Ishida, Takayuki; Nogami, Takashi; Iwasaki, Fujiko Bis(hfac)-copper(II) complexes bridged by pyrimidines showing magnetic interactions Acta Crystallographica Section B 57(6) (2001) 772-779
Space group: I 41 c d
Cell volume: 7474.9
Cell parameters: 18.3757; 18.3757; 22.137; 90; 90; 90;  

COD ID: 2201897
CIF file

HKL data

Original IUCr paper

Formula: - C21 H14 N2 O4 -
Comments: Anwar Usman; Hoong-Kun Fun; Hai-Liang Zhu; Gang Ke Bis(4-maleimidophenyl)methane Acta Crystallographica Section E 59(5) (2003) o652-o653
Space group: I 41 c d
Cell volume: 3532.9
Cell parameters: 12.988; 12.988; 20.9435; 90; 90; 90;  

COD ID: 2210390
CIF file

HKL data

Original IUCr paper

Formula: - C4 H12 Cd N10 O5 S -
Comments: Zhang, Guo-Fang; Zhao, Shu-Min; She, Jiang-Bo; Ng, Seik Weng Poly[[bis(μ~2~-3,5-diamino-1,2,4-triazole)-κ^2^<i>N</i>^2^:<i>N</i>^4^;κ^2^<i>N</i>^4^:<i>N</i>^2^-μ~2~-sulfato-κ^2^<i>O</i>:<i>O</i>'-cadmium(II)] monohydrate] Acta Crystallographica Section E 62(9) (2006) m2148-m2150
Space group: I 41 c d
Cell volume: 5058.6
Cell parameters: 13.446; 13.446; 27.98; 90; 90; 90;  

COD ID: 2224154
CIF file

HKL data

Original IUCr paper

Formula: - C10 H12 O4 -
Comments: He, Jun; Yang, Jin-cheng 1-(4-Hydroxy-3,5-dimethoxyphenyl)ethanone Acta Crystallographica Section E 65(12) (2009) o3030
Space group: I 41 c d
Cell volume: 3845.1
Cell parameters: 14.977; 14.977; 17.142; 90; 90; 90;  

COD ID: 2229452
CIF file

HKL data

Original IUCr paper

Formula: - C23 H14 N4 O -
Comments: Wang, Xiu-Yan; Ma, Shuai; He, Yu 1-(1<i>H</i>-Imidazo[4,5-<i>f</i>][1,10]phenanthrolin-2-yl)naphthalen-2-ol Acta Crystallographica Section E 67(3) (2011) o725
Space group: I 41 c d
Cell volume: 6995
Cell parameters: 22.58; 22.58; 13.7196; 90; 90; 90;  

COD ID: 2231225
CIF file

HKL data

Original IUCr paper

Formula: - C6 H7 N3 O5 -
Comments: Berrah, Fadila; Bouacida, Sofiane; Roisnel, Thierry 2-Amino-3-carboxypyridinium nitrate Acta Crystallographica Section E 67(8) (2011) o2057-o2058
Space group: I 41 c d
Cell volume: 3235
Cell parameters: 16.122; 16.122; 12.446; 90; 90; 90;  

COD ID: 2231815
CIF file

HKL data

Original IUCr paper

Formula: - C24 H18 N2 O6 -
Comments: Prabhakaran, Panchami; Puranik, Vedavati G.; Sanjayan, Gangadhar J. 1,8-Bis(4-methoxy-3-nitrophenyl)naphthalene Acta Crystallographica Section E 67(10) (2011) o2630
Space group: I 41 c d
Cell volume: 4033.1
Cell parameters: 13.3038; 13.3038; 22.7868; 90; 90; 90;  

COD ID: 2234068
CIF file

HKL data

Original IUCr paper

Formula: - C15 H18 Co N3 O12 -
Comments: Johnston, Dean H.; Brangham, Jack T.; Rapp, Christopher D. Tris(3-nitropentane-2,4-dionato-κ^2^<i>O</i>,<i>O</i>')cobalt(III) Acta Crystallographica Section E 68(3) (2012) m312-m313
Space group: I 41 c d
Cell volume: 8020.9
Cell parameters: 32.7078; 32.7078; 7.4976; 90; 90; 90;  

COD ID: 2234397
CIF file

HKL data

Original IUCr paper

Formula: - C22 H18 Cl2 N2 Zn -
Comments: Dharmalingam, Sivanesan; Lee, Ha-Jin; Yoon, Sungho Dichloridobis(2-phenylpyridine-κ<i>N</i>)zinc(II) Acta Crystallographica Section E 68(4) (2012) m431-m432
Space group: I 41 c d
Cell volume: 3837.1
Cell parameters: 15.2803; 15.2803; 16.4339; 90; 90; 90;  

COD ID: 2235170
CIF file

HKL data

Original IUCr paper

Formula: - C23 H28 Br2 S -
Comments: Rubio, Omayra H.; Fuentes de Arriba, Angel L.; Sanz, Francisca; Muniz, Francisco M.; Morán, Joaquín R. 4,5-Dibromo-2,7-di-<i>tert</i>-butyl-9,9-dimethyl-9<i>H</i>-thioxanthene Acta Crystallographica Section E 68(6) (2012) o1814
Space group: I 41 c d
Cell volume: 8954.9
Cell parameters: 21.8234; 21.8234; 18.8025; 90; 90; 90;  

COD ID: 2240232
CIF file

HKL data

Formula: - C12 H24 I Li O3 -
Comments: Gärtner, Stefanie; Gärtner, Tobias; Gschwind, Ruth-Maria; Korber, Nikolaus About the polymorphism of [Li(C~4~H~8~O)~3~]I: crystal structures of trigonal and tetragonal polymorphs Acta Crystallographica Section E 70(12) (2014) 555-558
Space group: I 41 c d
Cell volume: 6191
Cell parameters: 18.288; 18.288; 18.511; 90; 90; 90;  

COD ID: 2241740
CIF file

HKL data

Original IUCr paper

Formula: - C10 H7 N3 O4 S -
Comments: Cardoso, Laura N. F.; Nogueira, Thais C. M.; Wardell, James L.; Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Jotani, Mukesh M.; Tiekink, Edward R. T. <i>N</i>'-[(1<i>E</i>)-(5-Nitrofuran-2-yl)methylidene]thiophene-2-carbohydrazide: crystal structure and Hirshfeld surface analysis Acta Crystallographica Section E 72(7) (2016) 1025-1031
Space group: I 41 c d
Cell volume: 4390
Cell parameters: 17.4072; 17.4072; 14.4881; 90; 90; 90;  

COD ID: 2243213
CIF file

Original IUCr paper

Formula: - C14 H16 N2 O2 S2 -
Comments: Bibila Mayaya Bisseyou, Yvon; Ouattara, Mahama; Soro, Pénétjiligué Adama; Yao-Kakou, R. C. A.; Tenon, Abodou Jules Crystal structure, Hirshfeld surface analysis and contact enrichment ratios of 1-(2,7-dimethylimidazo[1,2-<i>a</i>]pyridin-3-yl)-2-(1,3-dithiolan-2-ylidene)ethanone monohydrate Acta Crystallographica Section E 75(12) (2019) 1934-1939
Space group: I 41 c d
Cell volume: 5842.3
Cell parameters: 28.3247; 28.3247; 7.282; 90; 90; 90;  

COD ID: 4031402
CIF file Formula: - B20 H26 -
Comments: Boocock, S.K.; Kennedy, J.D.; Greenwood, N.N.; Staves, J.; McDonald, W.S. The chemistry of isomeric icosaboranes, B20 H26. Molecular structures and physical characterization of 2,2'-Bi(nido-decaboranyl) and 2,6'-Bi(nido-decaboranyl) Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-) 1980 (1980) 790-796
Space group: I 41 c d
Cell volume: 3276.7
Cell parameters: 11.901; 11.901; 23.135; 90; 90; 90;  

COD ID: 4031507
CIF file Formula: - H6 Mo2 O11 Zr -
Comments: Clearfield, A.; Blessing, R.H. The preparation and crystal structure of a basic zirconium molybdate and its relationship to ion exchange gels Journal of Inorganic and Nuclear Chemistry 34 (1972) 2643-2663
Space group: I 41 c d
Cell volume: 1637.47
Cell parameters: 11.45; 11.45; 12.49; 90; 90; 90;  

COD ID: 4032373
CIF file Formula: - C17 H14 N2 O2 -
Comments: Aksenov, Alexander V.; Aksenov, Dmitrii A.; Orazova, Naila A.; Aksenov, Nicolai A.; Griaznov, Georgii D.; De Carvalho, Annelise; Kiss, Robert; Mathieu, Véronique; Kornienko, Alexander; Rubin, Michael One-Pot, Three-Component Assembly of Indoloquinolines: Total Synthesis of Isocryptolepine. The Journal of organic chemistry 82(6) (2017) 3011-3018
Space group: I 41 c d
Cell volume: 5286
Cell parameters: 20.00573; 20.00573; 13.20742; 90; 90; 90;  

COD ID: 4038431
CIF file Formula: - C22 H18 O -
Comments: Bartolo, Nicole D.; Woerpel, K. A. Evidence Against Single-Electron Transfer in the Additions of Most Organomagnesium Reagents to Carbonyl Compounds. The Journal of organic chemistry (2020)
Space group: I 41 c d
Cell volume: 6427.7
Cell parameters: 28.371; 28.371; 7.9856; 90; 90; 90;  

COD ID: 4060153
CIF file Formula: - C30 H52 Cl2 Si2 Zr -
Comments: Organometallics (2005)
Space group: I 41 c d
Cell volume: 6661.4
Cell parameters: 18.5194; 18.5194; 19.4228; 90; 90; 90;  

COD ID: 4062751
CIF file Formula: - C45 H50 F3 N3 O5 Pd S -
Comments: Organometallics (2004)
Space group: I 41 c d
Cell volume: 17829.3
Cell parameters: 31.0575; 31.0575; 18.4842; 90; 90; 90;  

COD ID: 4071494
CIF file Formula: - C22 H45 Al Si4 -
Comments: Uhl, Werner; Er, Elif; Hepp, Alexander; Kösters, Jutta; Grunenberg, Jörg Reactions of Terminal Alkynes with a Bulky Dialkylaluminum Hydride: Hydroalumination versus Deprotonation Organometallics 27(14) (2008) 3346
Space group: I 41 c d
Cell volume: 5704
Cell parameters: 15.4927; 15.4927; 23.7644; 90; 90; 90;  

COD ID: 4072965
CIF file Formula: - C24 H44 P2 Pd -
Comments: Johansson, Roger; Wendt, Ola F. Synthesis and Reactivity of (PCP) Palladium Hydroxy Carbonyl and Related Complexes toward CO2and Phenylacetylene Organometallics 26(9) (2007) 2426
Space group: I 41 c d
Cell volume: 5188.8
Cell parameters: 16.3617; 16.3617; 19.3825; 90; 90; 90;  

COD ID: 4074670
CIF file Formula: - C26 H41 N3 Ti -
Comments: Guiducci, Aldo E.; Boyd, Catherine L.; Mountford, Philip Reactions of Cyclopentadienyl-Amidinate Titanium Imido Compounds with CS2, COS, Isocyanates, and Other Unsaturated Organic Compounds Organometallics 25(5) (2006) 1167-1187
Space group: I 41 c d
Cell volume: 10271.1
Cell parameters: 20.5223; 20.5223; 24.3873; 90; 90; 90;  

COD ID: 4075099
CIF file Formula: - C55 H68 B Cl2 Cu F4 N4 -
Comments: Díez-González, Silvia; Scott, Natalie M.; Nolan, Steven P. Cationic Copper(I) Complexes as Efficient Precatalysts for the Hydrosilylation of Carbonyl Compounds Organometallics 25(9) (2006) 2355
Space group: I 41 c d
Cell volume: 22535.7
Cell parameters: 25.989; 25.989; 33.365; 90; 90; 90;  

COD ID: 4076575
CIF file Formula: - C21 H18 Br O2 P W -
Comments: Fischer, Paul J.; Neary, Michelle C.; Avena, Laura; Sullivan, Kevin P.; Hackbarth, Kent C. Dicarbonyl{[2-(diphenylphosphino)ethyl]cyclopentadienyl} Group VI Metal Hydrides, Halides, and Anions: Precursors for Olefin Epoxidation Catalysts Organometallics 31(6) (2012) 2437
Space group: I 41 c d
Cell volume: 7814.3
Cell parameters: 24.388; 24.388; 13.1383; 90; 90; 90;  

COD ID: 4079833
CIF file Formula: - C16 H44 Ga Na Si4 -
Comments: Armstrong, David R.; Brammer, Elanor; Cadenbach, Thomas; Hevia, Eva; Kennedy, Alan R. Co-complexation Syntheses, Structural Characterization, and DFT Studies of a Novel Series of Polymeric Alkali-Metal Tetraorganogallates Organometallics 32(2) (2013) 480
Space group: I 41 c d
Cell volume: 10127.7
Cell parameters: 28.189; 28.189; 12.7454; 90; 90; 90;  

COD ID: 4082014
CIF file Formula: - C13 H22 B Cl2 N2 Sc -
Comments: Wang, Xiufang; Peng, Weijie; Cui, Peng; Leng, Xuebing; Xia, Wei; Chen, Yaofeng Synthesis and Catalytic Activity of Amido-Boratabenzene Complexes of Rare-Earth Metals and Zirconium and Chromium Organometallics 32(21) (2013) 6166
Space group: I 41 c d
Cell volume: 6803.8
Cell parameters: 16.8816; 16.8816; 23.874; 90; 90; 90;  

COD ID: 4084390
CIF file Formula: - C17 H21 Cl3 N Rh S -
Comments: Mutoh, Yuichiro; Sakigawara, Masahiro; Niiyama, Ippei; Saito, Shinichi; Ishii, Youichi Synthesis of Rhodium‒Primary Thioamide Complexes and Their Desulfurization Leading to Rhodium Sulfido Cubane-Type Clusters and Nitriles Organometallics 33(19) (2014) 5414
Space group: I 41 c d
Cell volume: 8369
Cell parameters: 22.737; 22.737; 16.188; 90; 90; 90;  

COD ID: 4084391
CIF file Formula: - C18 H21 Cl2 F3 N Rh S -
Comments: Mutoh, Yuichiro; Sakigawara, Masahiro; Niiyama, Ippei; Saito, Shinichi; Ishii, Youichi Synthesis of Rhodium‒Primary Thioamide Complexes and Their Desulfurization Leading to Rhodium Sulfido Cubane-Type Clusters and Nitriles Organometallics 33(19) (2014) 5414
Space group: I 41 c d
Cell volume: 8815
Cell parameters: 23.591; 23.591; 15.839; 90; 90; 90;  

COD ID: 4084392
CIF file Formula: - C17 H21 Cl2 N2 O2 Rh S -
Comments: Mutoh, Yuichiro; Sakigawara, Masahiro; Niiyama, Ippei; Saito, Shinichi; Ishii, Youichi Synthesis of Rhodium‒Primary Thioamide Complexes and Their Desulfurization Leading to Rhodium Sulfido Cubane-Type Clusters and Nitriles Organometallics 33(19) (2014) 5414
Space group: I 41 c d
Cell volume: 8177
Cell parameters: 22.526; 22.526; 16.114; 90; 90; 90;  

COD ID: 4085210
CIF file Formula: - C23 H43 B2 Cl4 F8 N2 O2 P2 Rh -
Comments: Brill, Marcel; Rominger, Frank; Hofmann, Peter 1,2-Bis(di-tert-butylphosphino)imidazole (dtbpi): A Versatile Imidazole-Based, Rigid, Bulky Bisphosphine Ligand for Transition Metals Organometallics 34(2) (2015) 506
Space group: I 41 c d
Cell volume: 7338.7
Cell parameters: 18.7336; 18.7336; 20.9111; 90; 90; 90;  

COD ID: 4085881
CIF file Formula: - C104 H60 B2 Cu2 F48 N10 -
Comments: Saha, Sayantani; Kaur, Mandeep; Bera, Jitendra K. Fluorinated Anions Promoted “on Water” Activity of Di- and Tetranuclear Copper(I) Catalysts for Functional Triazole Synthesis Organometallics 34(12) (2015) 3047
Space group: I 41 c d
Cell volume: 24355
Cell parameters: 25.813; 25.813; 36.552; 90; 90; 90;  

COD ID: 4086644
CIF file Formula: - C20 H24 Br2 N2 Pd -
Comments: Behnia, Ava; Boyle, Paul D.; Blacquiere, Johanna M.; Puddephatt, Richard J. Selective Oxygen Atom Insertion into an Aryl‒Palladium Bond Organometallics 35(16) (2016) 2645
Space group: I 41 c d
Cell volume: 4269.2
Cell parameters: 17.252; 17.252; 14.344; 90; 90; 90;  

COD ID: 4103261
CIF file Formula: - C60 H34 -
Comments: Akihiro Shimizu; Takashi Kubo; Mikio Uruichi; Kyuya Yakushi; Masayoshi Nakano; Daisuke Shiomi; Kazunobu Sato; Takeji Takui; Yasukazu Hirao; Kouzou Matsumoto; Hiroyuki Kurata; Yasushi Morita; Kazuhiro Nakasuji Alternating Covalent Bonding Interactions in a One-Dimensional Chain of a Phenalenyl-Based Singlet Biradical Molecule Having Kekulé Structures Journal of the American Chemical Society 132 (2010) 14421-14428
Space group: I 41 c d
Cell volume: 7430.6
Cell parameters: 12.4649; 12.4649; 47.8243; 90; 90; 90;  

COD ID: 4104048
CIF file Formula: - C12 H12 N8 Zn2 -
Comments: Elinor C. Spencer; Ross J. Angel; Nancy L. Ross; Brian E. Hanson; Judith A. K. Howard Pressure-Induced Cooperative Bond Rearrangement in a Zinc Imidazolate Framework: A High-Pressure Single-Crystal X-Ray Diffraction Study Journal of the American Chemical Society 131 (2009) 4022-4026
Space group: I 41 c d
Cell volume: 6883.1
Cell parameters: 23.5028; 23.5028; 12.4607; 90; 90; 90;  

COD ID: 4104049
CIF file Formula: - C12 H12 N8 Zn2 -
Comments: Elinor C. Spencer; Ross J. Angel; Nancy L. Ross; Brian E. Hanson; Judith A. K. Howard Pressure-Induced Cooperative Bond Rearrangement in a Zinc Imidazolate Framework: A High-Pressure Single-Crystal X-Ray Diffraction Study Journal of the American Chemical Society 131 (2009) 4022-4026
Space group: I 41 c d
Cell volume: 6868.2
Cell parameters: 23.4856; 23.4856; 12.4521; 90; 90; 90;  

COD ID: 4104050
CIF file Formula: - C12 H12 N8 Zn2 -
Comments: Elinor C. Spencer; Ross J. Angel; Nancy L. Ross; Brian E. Hanson; Judith A. K. Howard Pressure-Induced Cooperative Bond Rearrangement in a Zinc Imidazolate Framework: A High-Pressure Single-Crystal X-Ray Diffraction Study Journal of the American Chemical Society 131 (2009) 4022-4026
Space group: I 41 c d
Cell volume: 6788.8
Cell parameters: 23.3569; 23.3569; 12.4441; 90; 90; 90;  

COD ID: 4104051
CIF file Formula: - C12 H12 N8 Zn2 -
Comments: Elinor C. Spencer; Ross J. Angel; Nancy L. Ross; Brian E. Hanson; Judith A. K. Howard Pressure-Induced Cooperative Bond Rearrangement in a Zinc Imidazolate Framework: A High-Pressure Single-Crystal X-Ray Diffraction Study Journal of the American Chemical Society 131 (2009) 4022-4026
Space group: I 41 c d
Cell volume: 6707.2
Cell parameters: 23.2297; 23.2297; 12.4296; 90; 90; 90;  

COD ID: 4104052
CIF file Formula: - C12 H12 N8 Zn2 -
Comments: Elinor C. Spencer; Ross J. Angel; Nancy L. Ross; Brian E. Hanson; Judith A. K. Howard Pressure-Induced Cooperative Bond Rearrangement in a Zinc Imidazolate Framework: A High-Pressure Single-Crystal X-Ray Diffraction Study Journal of the American Chemical Society 131 (2009) 4022-4026
Space group: I 41 c d
Cell volume: 6587.7
Cell parameters: 23.0474; 23.0474; 12.402; 90; 90; 90;  

COD ID: 4107089
CIF file Formula: - C34 H36 Co2 N8 -
Comments: Elliott B. Hulley; Peter T. Wolczanski; Emil B. Lobkovsky Carbon-Carbon Bond Formation from Azaallyl and Imine Couplings about Metal-Metal Bonds Journal of the American Chemical Society 133 (2011) 18058-18061
Space group: I 41 c d
Cell volume: 5652.2
Cell parameters: 15.506; 15.506; 23.508; 90; 90; 90;  

COD ID: 4107090
CIF file Formula: - C34 H36 N8 Ni2 -
Comments: Elliott B. Hulley; Peter T. Wolczanski; Emil B. Lobkovsky Carbon-Carbon Bond Formation from Azaallyl and Imine Couplings about Metal-Metal Bonds Journal of the American Chemical Society 133 (2011) 18058-18061
Space group: I 41 c d
Cell volume: 5667.7
Cell parameters: 15.4762; 15.4762; 23.6634; 90; 90; 90;  

COD ID: 4114148
CIF file Formula: - C26.67 B0.76 Co0.76 Mg0.38 N1.52 O1.52 P2.29 -
Comments: Theodore A. Betley; Jonas C. Peters Dinitrogen Chemistry from Trigonally Coordinated Iron and Cobalt Platforms Journal of the American Chemical Society 125 (2003) 10782-10783
Space group: I 41 c d
Cell volume: 15987.4
Cell parameters: 22.4373; 22.4373; 31.7568; 90; 90; 90;  

COD ID: 4116983
CIF file Formula: - C26 H54 Fe4 I2 N6 Ni2 S8 -
Comments: Frank Osterloh; Wolfgang Saak; Siegfried Pohl Unidentate and Bidentate Binding of Nickel(II) Complexes to an Fe4S4 Cluster via Bridging Thiolates: Synthesis, Crystal Structures, and Electrochemical Properties of Model Compounds for the Active Sites of Nickel Containing CO Dehydrogenase/Acetyl-CoA Synthase Journal of the American Chemical Society 119 (1997) 5648-5656
Space group: I 41 c d
Cell volume: 8958.3
Cell parameters: 20.888; 20.888; 20.532; 90; 90; 90;  

COD ID: 4118386
CIF file Formula: - C25 H33 N3 O -
Comments: Shaoguang Zhang; Junnian Wei; Ming Zhan; Qian Luo; Chao Wang; Wen-Xiong Zhang; Zhenfeng Xi 2,6-Diazasemibullvalenes: Synthesis, Structural Characterization, Reaction Chemistry, and Theoretical Analysis Journal of the American Chemical Society 134 (2012) 11964-11967
Space group: I 41 c d
Cell volume: 9028
Cell parameters: 23.684; 23.684; 16.094; 90; 90; 90;  

COD ID: 4122836
CIF file Formula: - C45 H58 Co N4 -
Comments: Zhang, Long; Liu, Yuesheng; Deng, Liang Three-Coordinate Cobalt(IV) and Cobalt(V) Imido Complexes with N-Heterocyclic Carbene Ligation: Synthesis, Structure, and Their Distinct Reactivity in C-H Bond Amination. Journal of the American Chemical Society 136(44) (2014) 15525-15528
Space group: I 41 c d
Cell volume: 8024
Cell parameters: 16.843; 16.843; 28.286; 90; 90; 90;  

COD ID: 4128171
CIF file Formula: - C138 H90 B2 F40 Mn N9 O8 -
Comments: Hunt, Camden; Peterson, Madeline; Anderson, Cassidy; Chang, Tieyan; Wu, Guang; Scheiner, Steve; Ménard, Gabriel Switchable Aromaticity in an Isostructural Mn Phthalocyanine Series Isolated in Five Separate Redox States. Journal of the American Chemical Society 141(6) (2019) 2604-2613
Space group: I 41 c d
Cell volume: 30296
Cell parameters: 45.776; 45.776; 14.458; 90; 90; 90;  

COD ID: 4128636
CIF file Formula: - C6 H6 Co N4 -
Comments: Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society 141(31) (2019) 12362-12371
Space group: I 41 c d
Cell volume: 6872.9
Cell parameters: 23.4856; 23.4856; 12.4606; 90; 90; 90;  

COD ID: 4128639
CIF file Formula: - C6 H6 Co N4 -
Comments: Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society 141(31) (2019) 12362-12371
Space group: I 41 c d
Cell volume: 6902
Cell parameters: 23.549; 23.549; 12.446; 90; 90; 90;  

COD ID: 4128640
CIF file Formula: - C6 H6 Co N4 -
Comments: Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society 141(31) (2019) 12362-12371
Space group: I 41 c d
Cell volume: 6844.6
Cell parameters: 23.4363; 23.4363; 12.4615; 90; 90; 90;  

COD ID: 4128653
CIF file Formula: - C6 H6 Co N4 -
Comments: Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption. Journal of the American Chemical Society 141(31) (2019) 12362-12371
Space group: I 41 c d
Cell volume: 6823.1
Cell parameters: 23.3963; 23.3963; 12.4649; 90; 90; 90;  

COD ID: 4306457
CIF file Formula: - C29 H73 Li3 O5 Sc2 -
Comments: Mathias U. Kramer; Dominique Robert; Stefan Arndt; Peter M. Zeimentz; Thomas P. Spaniol; Ahmed Yahia; Laurent Maron; Odile Eisenstein; Jun Okuda Cationic Methyl Complexes of the Rare-Earth Metals: An Experimental and Computational Study on Synthesis, Structure, and Reactivity Inorganic Chemistry 47 (2008) 9265-9278
Space group: I 41 c d
Cell volume: 8002
Cell parameters: 16.34; 16.34; 29.97; 90; 90; 90;  

COD ID: 4309711
CIF file Formula: - C7 H7 N O7 Zn -
Comments: Li-Li Wen; Dong-Bin Dang; Chun-Ying Duan; Yi-Zhi Li; Zheng-Fang Tian; Qing-Jin Meng 1D Helix, 2D Brick-Wall and Herringbone, and 3D Interpenetration d10 Metal-Organic Framework Structures Assembled from Pyridine-2,6-dicarboxylic AcidN-Oxide Inorganic Chemistry 44 (2005) 7161-7170
Space group: I 41 c d
Cell volume: 3676.5
Cell parameters: 16.675; 16.675; 13.222; 90; 90; 90;  

COD ID: 4310522
CIF file Formula: - C32 H58 Cu N2 O8 P2 -
Comments: Ramaswamy Murugavel; Malaichamy Sathiyendiran; Ramasamy Pothiraja; Mrinalini G. Walawalkar; Talal Mallah; Eric Riviére Monomeric, Tetrameric, and Polymeric Copper Di-tert-butyl Phosphate Complexes Containing Pyridine Ancillary Ligands Inorganic Chemistry 43 (2004) 945-953
Space group: I 41 c d
Cell volume: 7587
Cell parameters: 19.961; 19.961; 19.041; 90; 90; 90;  

COD ID: 4317889
CIF file Formula: - C6 H12 As Cl3 S3 -
Comments: Nicholas J. Hill; William Levason; Gillian Reid Arsenic(III) Halide Complexes with Acyclic and Macrocyclic Thio- and Selenoether Coligands: Synthesis and Structural Properties Inorganic Chemistry 41 (2002) 2070-2076
Space group: I 41 c d
Cell volume: 5154
Cell parameters: 17.52; 17.52; 16.79; 90; 90; 90;  

COD ID: 4322672
CIF file Formula: - H2 O8 P2 Zr -
Comments: Anne Marie Krogh Andersen; Poul Norby; Jonathan C. Hanson; Tom Vogt Preparation and Characterization of a New 3-Dimensional Zirconium Hydrogen Phosphate, τ-Zr(HPO~4~)~2~. Determination of the Complete Crystal Structure Combining Synchrotron X-ray Single-Crystal Diffraction and Neutron Powder Diffraction Inorganic Chemistry 37 (1998) 876-881
Space group: I 41 c d
Cell volume: 1361.8
Cell parameters: 11.255; 11.255; 10.75; 90; 90; 90;  

COD ID: 4331085
CIF file Formula: - C43 H59 B Cl8 N4 Si2 Zr -
Comments: Heiko Kulinna; Thomas P. Spaniol; Laurent Maron; Jun Okuda Cationic Zirconium Hydrides Supported by an NNNN-Type Macrocyclic Ligand: Synthesis, Structure, and Reactivity Inorganic Chemistry 51 (2012) 12462-12472
Space group: I 41 c d
Cell volume: 20553
Cell parameters: 24.293; 24.293; 34.827; 90; 90; 90;  

COD ID: 4332907
CIF file Formula: - C3 H10 Fe N2 O10 S2 -
Comments: Fu, Yunlong; Xu, Zhiwei; Ren, Jialin; Wu, Haishun; Yuan, Rong Organically Directed Iron Sulfate Chains: Structural Diversity Based on Hydrogen Bonding Interactions Inorganic Chemistry 45(20) (2006) 8452-8458
Space group: I 41 c d
Cell volume: 4648.5
Cell parameters: 19.5273; 19.5273; 12.1908; 90; 90; 90;  

COD ID: 4336169
CIF file Formula: - C15 H19 I2 O6 Ru -
Comments: Jun Yoshida; Go Watanabe; Kaori Kakizawa; Yasuhiro Kawabata; Hidetaka Yuge Tris(β-diketonato) Ru(III) Complexes as Chiral Dopants for Nematic Liquid Crystals: the Effect of the Molecular Structure on the Helical Twisting Power Inorganic Chemistry 52 (2013) 11042-11050
Space group: I 41 c d
Cell volume: 8578
Cell parameters: 34.044; 34.044; 7.401; 90; 90; 90;  

COD ID: 4338608
CIF file Formula: - C24 H44 Ni P2 -
Comments: Boro, Brian J.; Duesler, Eileen N.; Goldberg, Karen I.; Kemp, Richard A. Synthesis, Characterization, and Reactivity of Nickel Hydride Complexes Containing 2,6-C6H3(CH2PR2)2(R = tBu,cHex, and iPr) Pincer Ligands Inorganic Chemistry 48(12) (2009) 5081-5087
Space group: I 41 c d
Cell volume: 5003.8
Cell parameters: 16.1519; 16.1519; 19.1801; 90; 90; 90;  

COD ID: 4343675
CIF file Formula: - B2 Be H8 -
Comments: Marynick, D.S.; Lipscomb, W.N. Crystal structure of beryllium borohydride Inorganic Chemistry 11 (1972) 820-823
Space group: I 41 c d
Cell volume: 1688.09
Cell parameters: 13.62; 13.62; 9.1; 90; 90; 90;  

COD ID: 4346162
CIF file Formula: - C68 H52 Ir2 N8 O12 Zn -
Comments: Li, Lina; Zhang, Shuquan; Xu, Yingying; Zhao, Sangen; Sun, Zhihua; Luo, Junhua Dynamic entangled framework based on an iridium-organic unit showing reversible luminescence turn-on sensing. Inorganic chemistry 54(18) (2015) 8872-8874
Space group: I 41 c d
Cell volume: 14420.4
Cell parameters: 17.143; 17.143; 49.0687; 90; 90; 90;  

COD ID: 4347760
CIF file Formula: - C28 H30 N2 P2 Sn -
Comments: Arras, Janet; Eichele, Klaus; Maryasin, Boris; Schubert, Hartmut; Ochsenfeld, Christian; Wesemann, Lars Intermolecular (119)Sn,(31)P Through-Space Spin-Spin Coupling in a Solid Bivalent Tin Phosphido Complex. Inorganic chemistry 55(9) (2016) 4669-4675
Space group: I 41 c d
Cell volume: 5150.4
Cell parameters: 21.082; 21.082; 11.5882; 90; 90; 90;  

COD ID: 4348424
CIF file Formula: - C18 H20 Br N4 P -
Comments: Macdonald, Charles L. B.; Binder, Justin F.; Swidan, Ala'aeddeen; Nguyen, Jennifer H.; Kosnik, Stephanie C.; Ellis, Bobby D. Convenient Preparation and Detailed Analysis of a Series of NHC-Stabilized Phosphorus(I) Dyes and Their Derivatives. Inorganic chemistry 55(14) (2016) 7152-7166
Space group: I 41 c d
Cell volume: 7408.6
Cell parameters: 20.0956; 20.0956; 18.3456; 90; 90; 90;  

COD ID: 4502962
CIF file Formula: - C32 H28 Br2 Co N4 -
Comments: Kounavi, Konstantina A.; Manos, Manolis J.; Moushi, Eleni E.; Kitos, Alexandros A.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios A Systematic Evaluation of the Interplay of Weak and Strong Supramolecular Interactions in a Series of Co(II) and Zn(II) Complexes Tuned by Ligand Modification Crystal Growth & Design 12(1) (2012) 429
Space group: I 41 c d
Cell volume: 11555.8
Cell parameters: 28.6528; 28.6528; 14.0756; 90; 90; 90;  

COD ID: 4502963
CIF file Formula: - C32 H28 Co I2 N4 -
Comments: Kounavi, Konstantina A.; Manos, Manolis J.; Moushi, Eleni E.; Kitos, Alexandros A.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios A Systematic Evaluation of the Interplay of Weak and Strong Supramolecular Interactions in a Series of Co(II) and Zn(II) Complexes Tuned by Ligand Modification Crystal Growth & Design 12(1) (2012) 429
Space group: I 41 c d
Cell volume: 12016.7
Cell parameters: 29.0776; 29.0776; 14.2124; 90; 90; 90;  

COD ID: 4502964
CIF file Formula: - C32 H28 Co N6 O4 -
Comments: Kounavi, Konstantina A.; Manos, Manolis J.; Moushi, Eleni E.; Kitos, Alexandros A.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios A Systematic Evaluation of the Interplay of Weak and Strong Supramolecular Interactions in a Series of Co(II) and Zn(II) Complexes Tuned by Ligand Modification Crystal Growth & Design 12(1) (2012) 429
Space group: I 41 c d
Cell volume: 11493.6
Cell parameters: 28.4928; 28.4928; 14.1575; 90; 90; 90;  

COD ID: 4502973
CIF file Formula: - C32 H28 Br2 N4 Zn -
Comments: Kounavi, Konstantina A.; Manos, Manolis J.; Moushi, Eleni E.; Kitos, Alexandros A.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios A Systematic Evaluation of the Interplay of Weak and Strong Supramolecular Interactions in a Series of Co(II) and Zn(II) Complexes Tuned by Ligand Modification Crystal Growth & Design 12(1) (2012) 429
Space group: I 41 c d
Cell volume: 11579.3
Cell parameters: 28.6569; 28.6569; 14.1002; 90; 90; 90;  

COD ID: 4502974
CIF file Formula: - C32 H28 I2 N4 Zn -
Comments: Kounavi, Konstantina A.; Manos, Manolis J.; Moushi, Eleni E.; Kitos, Alexandros A.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios A Systematic Evaluation of the Interplay of Weak and Strong Supramolecular Interactions in a Series of Co(II) and Zn(II) Complexes Tuned by Ligand Modification Crystal Growth & Design 12(1) (2012) 429
Space group: I 41 c d
Cell volume: 12040.9
Cell parameters: 29.0876; 29.0876; 14.2312; 90; 90; 90;  

COD ID: 4502975
CIF file Formula: - C32 H28 N6 O4 Zn -
Comments: Kounavi, Konstantina A.; Manos, Manolis J.; Moushi, Eleni E.; Kitos, Alexandros A.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios A Systematic Evaluation of the Interplay of Weak and Strong Supramolecular Interactions in a Series of Co(II) and Zn(II) Complexes Tuned by Ligand Modification Crystal Growth & Design 12(1) (2012) 429
Space group: I 41 c d
Cell volume: 11544.6
Cell parameters: 28.4382; 28.4382; 14.2749; 90; 90; 90;  

COD ID: 4514151
CIF file Formula: - C13 H22 F3 Ir N2 O2 S -
Comments: Matsunami, Asuka; Kuwata, Shigeki; Kayaki, Yoshihito A Bifunctional Iridium Catalyst Modified for Persistent Hydrogen Generation from Formic Acid: Understanding Deactivation via Cyclometalation of a 1,2-Diphenylethylenediamine Motif ACS Catalysis (2017) 4479
Space group: I 41 c d
Cell volume: 6470.8
Cell parameters: 16.7238; 16.7238; 23.136; 90; 90; 90;  

COD ID: 6000655
CIF file Formula: - H2 O8 P2 Zr -
Comments: Andersen, A. M. K.; Norby, P.; Hanson, J. C.; Vogt, T. Preparation and characterization of a new 3-dimensional zirconium hydrogen phosphate, tau-Zr(HPO4)(2). Determination of the complete crystal structure combining synchrotron x-ray single-crystal diffraction and neutron powder diffraction Inorganic Chemistry 37 (1998) 876-881
Space group: I 41 c d
Cell volume: 1364.5
Cell parameters: 11.259; 11.259; 10.764; 90; 90; 90;  

COD ID: 7002572
CIF file Formula: - C62 H90 Al2 O4 S4 -
Comments: Lian, Bing; Ma, Haiyan; Spaniol, Thomas P.; Okuda, Jun Neutral and cationic aluminium complexes containing a chiral (OSSO)-type bis(phenolato) ligand: synthesis, structures and polymerization activity Dalton Transactions (issue 41) (2009) 9033-9042
Space group: I 41 c d
Cell volume: 12653.7
Cell parameters: 18.7075; 18.7075; 36.1564; 90; 90; 90;  

COD ID: 7002996
CIF file Formula: - C108 H148 N64 O8 Ru8 -
Comments: Sun, Raymond Wai-Yin; Ng, Miro Fei-Yeung; Wong, Ella Lai-Ming; Zhang, Jingfei; Chui, Stephen Sin-Yin; Shek, Lam; Lau, Tai-Chu; Che, Chi-Ming Dual anti-angiogenic and cytotoxic properties of ruthenium(iii) complexes containing pyrazolato and/or pyrazole ligands Dalton Transactions (issue 48) (2009) 10712-10716
Space group: I 41 c d
Cell volume: 13360.4
Cell parameters: 29.5958; 29.5958; 15.2531; 90; 90; 90;  

COD ID: 7003267
CIF file Formula: - C22 H44 N4 Ni -
Comments: Danopoulos, Andreas A.; Pugh, David A method for the synthesis of nickel(0) bis(carbene) complexes Dalton Transactions (issue 1) (2008) 30
Space group: I 41 c d
Cell volume: 4785.5
Cell parameters: 11.6779; 11.6779; 35.091; 90; 90; 90;  

COD ID: 7008874
CIF file Formula: - C58 H92 Li2 N3 Nd O4 Si2 -
Comments: Lu, Min; Yao, Yingming; Zhang, Yong; Shen, Qi Synthesis and characterization of anionic rare-earth metal amides stabilized by phenoxy-amido ligands and their catalytic behavior for the polymerization of lactide. Dalton transactions (Cambridge, England : 2003) 39(40) (2010) 9530-9537
Space group: I 41 c d
Cell volume: 12480
Cell parameters: 21.635; 21.635; 26.662; 90; 90; 90;  

COD ID: 7008875
CIF file Formula: - C58 H92 Li2 N3 O4 Si2 Sm -
Comments: Lu, Min; Yao, Yingming; Zhang, Yong; Shen, Qi Synthesis and characterization of anionic rare-earth metal amides stabilized by phenoxy-amido ligands and their catalytic behavior for the polymerization of lactide. Dalton transactions (Cambridge, England : 2003) 39(40) (2010) 9530-9537
Space group: I 41 c d
Cell volume: 12367
Cell parameters: 21.5715; 21.5715; 26.577; 90; 90; 90;  

COD ID: 7008876
CIF file Formula: - C58 H92 Li2 N3 O4 Si2 Yb -
Comments: Lu, Min; Yao, Yingming; Zhang, Yong; Shen, Qi Synthesis and characterization of anionic rare-earth metal amides stabilized by phenoxy-amido ligands and their catalytic behavior for the polymerization of lactide. Dalton transactions (Cambridge, England : 2003) 39(40) (2010) 9530-9537
Space group: I 41 c d
Cell volume: 12248.4
Cell parameters: 21.5166; 21.5166; 26.4564; 90; 90; 90;  

COD ID: 7008877
CIF file Formula: - C58 H92 Li2 N3 O4 Si2 Y -
Comments: Lu, Min; Yao, Yingming; Zhang, Yong; Shen, Qi Synthesis and characterization of anionic rare-earth metal amides stabilized by phenoxy-amido ligands and their catalytic behavior for the polymerization of lactide. Dalton transactions (Cambridge, England : 2003) 39(40) (2010) 9530-9537
Space group: I 41 c d
Cell volume: 12329.3
Cell parameters: 21.5684; 21.5684; 26.5034; 90; 90; 90;  

COD ID: 7010163
CIF file Formula: - C14 H24 Fe3 N2 O2 S6 -
Comments: Davies, Sian C.; Durrant, Marcus C.; Hughes, David L.; Richards, Raymond L.; Sanders, J. Roger Iron, cobalt and vanadium complexes of the N(CH2CH2S)33− ligand with chloride, azide, cyanide and carbonyl co-ligands Journal of the Chemical Society, Dalton Transactions (issue 24) (2000) 4694
Space group: I 41 c d
Cell volume: 4486.4
Cell parameters: 13.5324; 13.5324; 24.499; 90; 90; 90;  

COD ID: 7010164
CIF file Formula: - C14 H24 Co Fe2 N2 O2 S6 -
Comments: Davies, Sian C.; Durrant, Marcus C.; Hughes, David L.; Richards, Raymond L.; Sanders, J. Roger Iron, cobalt and vanadium complexes of the N(CH2CH2S)33− ligand with chloride, azide, cyanide and carbonyl co-ligands Journal of the Chemical Society, Dalton Transactions (issue 24) (2000) 4694
Space group: I 41 c d
Cell volume: 4467.7
Cell parameters: 13.5277; 13.5277; 24.414; 90; 90; 90;  

COD ID: 7010703
CIF file Formula: - C14 H24 Fe2 N2 Ni O2 S6 -
Comments: Smith, Matt C.; Longhurst, Steven; Barclay, J. Elaine; Cramer, Stephen P.; Davies, Sian C.; Hughes, David L.; Gu, Wei-Wei; Evans, David J. Nickel(II) in an almost regular tetrahedral thiolate environment: a first generation synthetic analogue of the active site of nickel CO-dehydrogenase Journal of the Chemical Society, Dalton Transactions (issue 9) (2001) 1387
Space group: I 41 c d
Cell volume: 4447.4
Cell parameters: 13.5088; 13.5088; 24.371; 90; 90; 90;  

COD ID: 7011939
CIF file Formula: - C14 H11 Fe N8 O1.5 -
Comments: Susana Martín; M. Gotzone Barandika; J. M. Ezpeleta; Roberto Cortés; J. I. Ruiz de Larramendi; Luis Lezama; Teófilo Rojo Structural analysis and magnetic properties of the 1D [Fe(dca)2bipy(H2O)]·1/2H2O and the 3D [Ni(dca)2bipy] (dca = dicyanamide; bipy = 4,4'-bipyridine) J. Chem. Soc., Dalton Trans. (issue 22) (2002) 4275-4280
Space group: I 41 c d
Cell volume: 6659
Cell parameters: 22.366; 22.366; 13.311; 90; 90; 90;  

COD ID: 7015690
CIF file Formula: - C24 H43 F Ni P2 -
Comments: Rossin, Andrea; Peruzzini, Maurizio; Zanobini, Fabrizio Nickel(II) hydride and fluoride pincer complexes and their reactivity with Lewis acids BX3·L (X = H, L = thf; X = F, L = Et2O). Dalton transactions (Cambridge, England : 2003) 40(17) (2011) 4447-4452
Space group: I 41 c d
Cell volume: 5027
Cell parameters: 16.044; 16.044; 19.529; 90; 90; 90;  

COD ID: 7018979
CIF file Formula: - C36 H198 Co10 Ge8 N36 O119 V32 -
Comments: Gao, Yuanzhe; Xu, Yanqing; Huang, Kunlin; Han, Zhangang; Hu, Changwen Two three-dimensional {V16Ge4}-based open frameworks stabilized by diverse types of CoII-amine bridges and magnetic properties Dalton Transactions 41(20) (2012) 6122
Space group: I 41 c d
Cell volume: 33164
Cell parameters: 30.5983; 30.5983; 35.422; 90; 90; 90;  

COD ID: 7019071
CIF file Formula: - C12 H17 Cl3 O Ti -
Comments: Suttil, James A.; McGuinness, David S.; Pichler, Markus; Gardiner, Michael G.; Morgan, David H.; Evans, Stephen J. Preparation and structures of aryloxy- and alkoxy-Ti(iv) complexes and their evaluation in ethylene oligomerisation and polymerisation. Dalton transactions (Cambridge, England : 2003) 41(22) (2012) 6625-6633
Space group: I 41 c d
Cell volume: 5972
Cell parameters: 25.2188; 25.219; 9.39; 90; 90; 90;  

COD ID: 7021531
CIF file Formula: - C56 H86 Cl2 Li2 N3 O4 Si2 Y -
Comments: Qiu, Jinshui; Lu, Min; Yao, Yingming; Zhang, Yong; Wang, Yaorong; Shen, Qi Synthesis and characterization of bimetallic lanthanide-alkali metal complexes stabilized by aminophenoxy ligands and their catalytic activity for the polymerization of 2,2-dimethyltrimethylene carbonate. Dalton transactions (Cambridge, England : 2003) 42(28) (2013) 10179-10189
Space group: I 41 c d
Cell volume: 12336.6
Cell parameters: 21.534; 21.534; 26.604; 90; 90; 90;  

COD ID: 7021532
CIF file Formula: - C56 H86 Cl2 Li2 N3 O4 Si2 Yb -
Comments: Qiu, Jinshui; Lu, Min; Yao, Yingming; Zhang, Yong; Wang, Yaorong; Shen, Qi Synthesis and characterization of bimetallic lanthanide-alkali metal complexes stabilized by aminophenoxy ligands and their catalytic activity for the polymerization of 2,2-dimethyltrimethylene carbonate. Dalton transactions (Cambridge, England : 2003) 42(28) (2013) 10179-10189
Space group: I 41 c d
Cell volume: 12244.1
Cell parameters: 21.4729; 21.4729; 26.555; 90; 90; 90;  

COD ID: 7021533
CIF file Formula: - C56 H86 Br2 Li2 N3 O4 Si2 Y -
Comments: Qiu, Jinshui; Lu, Min; Yao, Yingming; Zhang, Yong; Wang, Yaorong; Shen, Qi Synthesis and characterization of bimetallic lanthanide-alkali metal complexes stabilized by aminophenoxy ligands and their catalytic activity for the polymerization of 2,2-dimethyltrimethylene carbonate. Dalton transactions (Cambridge, England : 2003) 42(28) (2013) 10179-10189
Space group: I 41 c d
Cell volume: 12402
Cell parameters: 21.645; 21.645; 26.471; 90; 90; 90;  

COD ID: 7021534
CIF file Formula: - C56 H86 Br2 Li2 N3 O4 Si2 Yb -
Comments: Qiu, Jinshui; Lu, Min; Yao, Yingming; Zhang, Yong; Wang, Yaorong; Shen, Qi Synthesis and characterization of bimetallic lanthanide-alkali metal complexes stabilized by aminophenoxy ligands and their catalytic activity for the polymerization of 2,2-dimethyltrimethylene carbonate. Dalton transactions (Cambridge, England : 2003) 42(28) (2013) 10179-10189
Space group: I 41 c d
Cell volume: 12317.7
Cell parameters: 21.5857; 21.5857; 26.4362; 90; 90; 90;  

COD ID: 7023214
CIF file Formula: - C24 H40 Cl2 Cu N8 O8 -
Comments: Ardizzoia, G. Attilio; Brenna, Stefano; Durini, Sara; Therrien, Bruno; Trentin, Ivan The Goldilocks principle in action: synthesis and structural characterization of a novel {Cu4(μ3-OH)4} cubane stabilized by monodentate ligands. Dalton transactions (Cambridge, England : 2003) 42(34) (2013) 12265-12273
Space group: I 41 c d
Cell volume: 6953.1
Cell parameters: 15.795; 15.795; 27.87; 90; 90; 90;  

COD ID: 7028090
CIF file Formula: - C12 H14 Fe O -
Comments: R. Pool, Brett; Sun, Chee-Chung; M. White, Jonathan Influence of the ferrocene substituent on C‒O bonds at the α position. Results from low-temperature X-ray structural studies Journal of the Chemical Society, Dalton Transactions (issue 8) (1998) 1269
Space group: I 41 c d
Cell volume: 4051.7
Cell parameters: 23.132; 23.132; 7.572; 90; 90; 90;  

COD ID: 7030095
CIF file Formula: - C22.5 H15 Br2 Cl2 Ir N2 -
Comments: Xu, Chen; Li, Hong-Mei; Xiao, Zhi-Qiang; Wang, Zhi-Qiang; Tang, Si-Fu; Ji, Bao-Ming; Hao, Xin-Qi; Song, Mao-Ping Cyclometalated Pd(ii) and Ir(iii) 2-(4-bromophenyl)pyridine complexes with N-heterocyclic carbenes (NHCs) and acetylacetonate (acac): synthesis, structures, luminescent properties and application in one-pot oxidation/Suzuki coupling of aryl chlorides containing hydroxymethyl. Dalton transactions (Cambridge, England : 2003) 43(26) (2014) 10235-10247
Space group: I 41 c d
Cell volume: 9072
Cell parameters: 16.6765; 16.6765; 32.62; 90; 90; 90;  

COD ID: 7031983
CIF file Formula: - C31 H30 F12 Mn N2 O6 P -
Comments: Reis, Samira G.; Del Águila-Sánchez, Miguel A; Guedes, Guilherme P.; Ferreira, Glaucio B.; Novak, Miguel A.; Speziali, Nivaldo L.; López-Ortiz, Fernando; Vaz, Maria G. F. Synthesis, crystal structures and magnetic behaviour of four coordination compounds constructed with a phosphinic amide-TEMPO radical and [M(hfac)2] (M = Cu(II), Co(II) and Mn(II)). Dalton transactions (Cambridge, England : 2003) 43(39) (2014) 14889-14901
Space group: I 41 c d
Cell volume: 14131.5
Cell parameters: 28.2516; 28.2516; 17.7052; 90; 90; 90;  

COD ID: 7031984
CIF file Formula: - C31 H30 Co F12 N2 O6 P -
Comments: Reis, Samira G.; Del Águila-Sánchez, Miguel A; Guedes, Guilherme P.; Ferreira, Glaucio B.; Novak, Miguel A.; Speziali, Nivaldo L.; López-Ortiz, Fernando; Vaz, Maria G. F. Synthesis, crystal structures and magnetic behaviour of four coordination compounds constructed with a phosphinic amide-TEMPO radical and [M(hfac)2] (M = Cu(II), Co(II) and Mn(II)). Dalton transactions (Cambridge, England : 2003) 43(39) (2014) 14889-14901
Space group: I 41 c d
Cell volume: 14663
Cell parameters: 28.414; 28.414; 18.162; 90; 90; 90;  

COD ID: 7034481
CIF file Formula: - C25 H24 N4 O2 -
Comments: Shi, Pengfei; Jiang, Qin; Zhao, Xuesong; Zhang, Qiong; Tian, Yupeng Study of the one-photon and two-photon properties of two water-soluble terpyridines and their zinc complexes. Dalton transactions (Cambridge, England : 2003) 44(17) (2015) 8041-8048
Space group: I 41 c d
Cell volume: 4273.1
Cell parameters: 11.9604; 11.9604; 29.871; 90; 90; 90;  

COD ID: 7034820
CIF file Formula: - C15 H12 Br2 N8 Pd -
Comments: Pinter, Piermaria; Biffis, Andrea; Tubaro, Cristina; Tenne, Mario; Kaliner, Maria; Strassner, Thomas Palladium(ii) complexes with electron-poor, 4,5-disubstituted diimidazol-2-ylidene ligands: synthesis, characterization and catalytic activity. Dalton transactions (Cambridge, England : 2003) 44(20) (2015) 9391-9399
Space group: I 41 c d
Cell volume: 7833.5
Cell parameters: 23.913; 23.913; 13.699; 90; 90; 90;  

COD ID: 7035721
CIF file Formula: - C44 H43 Cl Fe2 N6 O9 -
Comments: Sun, Ying-Ji; Huang, Qian-Qian; Li, Pei; Zhang, Jian-Jun Catalytic dioxygenation of flavonol by M(II)-complexes (M = Mn, Fe, Co, Ni, Cu and Zn) - mimicking the M(II)-substituted quercetin 2,3-dioxygenase. Dalton transactions (Cambridge, England : 2003) 44(31) (2015) 13926-13938
Space group: I 41 c d
Cell volume: 10052
Cell parameters: 16.545; 16.545; 36.72; 90; 90; 90;  

COD ID: 7038349
CIF file Formula: - C78 H51 Br2 Fe2 N5 -
Comments: Gehring, Henrike; Metzinger, Ramona; Braun, Beatrice; Herwig, Christian; Harder, Sjoerd; Ray, Kallol; Limberg, Christian An iron(ii) hydride complex of a ligand with two adjacent β-diketiminate binding sites and its reactivity. Dalton transactions (Cambridge, England : 2003) 45(7) (2016) 2989-2996
Space group: I 41 c d
Cell volume: 7658.2
Cell parameters: 15.8933; 15.8933; 30.318; 90; 90; 90;  

COD ID: 7041177
CIF file Formula: - C68 H88 F24 N2 O6 Sn2 -
Comments: Tsukada, Satoru; O'Brien, Nathan J; Kano, Naokazu; Kawashima, Takayuki; Guo, Jing-Dong; Nagase, Shigeru The synthesis and structure of a dianionic species with a bond between pentacoordinated tin atoms: bonding properties of the tin-tin bond. Dalton transactions (Cambridge, England : 2003) 45(48) (2016) 19374-19379
Space group: I 41 c d
Cell volume: 15019
Cell parameters: 20.2864; 20.2864; 36.4947; 90; 90; 90;  

COD ID: 7047963
CIF file Formula: - C27 H24 F12 Fe N10 O5 Sb2 -
Comments: García-López, Víctor; Palacios-Corella, Mario; Abhervé, Alexandre; Pellicer-Carreño, Isaac; Desplanches, Cédric; Clemente-León, Miguel; Coronado, Eugenio Spin-crossover compounds based on iron(ii) complexes of 2,6-bis(pyrazol-1-yl)pyridine (bpp) functionalized with carboxylic acid and ethyl carboxylic acid. Dalton transactions (Cambridge, England : 2003) 47(47) (2018) 16958-16968
Space group: I 41 c d
Cell volume: 8330.4
Cell parameters: 23.6034; 23.6034; 14.9526; 90; 90; 90;  

COD ID: 7047964
CIF file Formula: - C30 H30 As2 F12 Fe N10 O6 -
Comments: García-López, Víctor; Palacios-Corella, Mario; Abhervé, Alexandre; Pellicer-Carreño, Isaac; Desplanches, Cédric; Clemente-León, Miguel; Coronado, Eugenio Spin-crossover compounds based on iron(ii) complexes of 2,6-bis(pyrazol-1-yl)pyridine (bpp) functionalized with carboxylic acid and ethyl carboxylic acid. Dalton transactions (Cambridge, England : 2003) 47(47) (2018) 16958-16968
Space group: I 41 c d
Cell volume: 7843.1
Cell parameters: 23.3533; 23.3533; 14.3811; 90; 90; 90;  

COD ID: 7047965
CIF file Formula: - C30 H30 F12 Fe N10 O6 Sb2 -
Comments: García-López, Víctor; Palacios-Corella, Mario; Abhervé, Alexandre; Pellicer-Carreño, Isaac; Desplanches, Cédric; Clemente-León, Miguel; Coronado, Eugenio Spin-crossover compounds based on iron(ii) complexes of 2,6-bis(pyrazol-1-yl)pyridine (bpp) functionalized with carboxylic acid and ethyl carboxylic acid. Dalton transactions (Cambridge, England : 2003) 47(47) (2018) 16958-16968
Space group: I 41 c d
Cell volume: 8065.76
Cell parameters: 23.4653; 23.4653; 14.6485; 90; 90; 90;  

COD ID: 7047967
CIF file Formula: - C27 H24 As2 F12 Fe N10 O5 -
Comments: García-López, Víctor; Palacios-Corella, Mario; Abhervé, Alexandre; Pellicer-Carreño, Isaac; Desplanches, Cédric; Clemente-León, Miguel; Coronado, Eugenio Spin-crossover compounds based on iron(ii) complexes of 2,6-bis(pyrazol-1-yl)pyridine (bpp) functionalized with carboxylic acid and ethyl carboxylic acid. Dalton transactions (Cambridge, England : 2003) 47(47) (2018) 16958-16968
Space group: I 41 c d
Cell volume: 8031
Cell parameters: 23.4197; 23.4197; 14.6422; 90; 90; 90;  

COD ID: 7050057
CIF file Formula: - C36 H26 Eu2 O16 -
Comments: Zheng, Xiang-Jun; Jin, Lin-Pei; Gao, Song; Lu, Shao-Zhe Second ligand-directed self-assembly of lanthanide(iii) coordination polymers with 1,4-naphthalenedicarboxylate New Journal of Chemistry 29(6) (2005) 798
Space group: I 41 c d
Cell volume: 14536
Cell parameters: 30.392; 30.392; 15.737; 90; 90; 90;  

COD ID: 7050058
CIF file Formula: - C36 H25 Gd2 O15.5 -
Comments: Zheng, Xiang-Jun; Jin, Lin-Pei; Gao, Song; Lu, Shao-Zhe Second ligand-directed self-assembly of lanthanide(iii) coordination polymers with 1,4-naphthalenedicarboxylate New Journal of Chemistry 29(6) (2005) 798
Space group: I 41 c d
Cell volume: 14560
Cell parameters: 30.408; 30.408; 15.747; 90; 90; 90;  

COD ID: 7050783
CIF file Formula: - C14 H18 Cu N4 O4 -
Comments: Lah, Nina; Koller, Joze; Giester, Gerald; Segedin, Primoz; Leban, Ivan Copper(II) carboxylates with 4-aminopyridine: neutral mononuclear structures, isomerism of aceto compounds and a novel tetranuclear structure New Journal of Chemistry 26(7) (2002) 933
Space group: I 41 c d
Cell volume: 3498.51
Cell parameters: 10.6062; 10.6062; 31.1002; 90; 90; 90;  

COD ID: 7051133
CIF file Formula: - C26 H32 Cl2 Co N4 O12 -
Comments: De Munno, Giovanni; Francesca Cipriani; Donatella Armentano; Miguel Julve; Jose Antonio Real Polycatenane systems from Co(II) and trans-1,2-bis(4-pyridyl)ethene [bpe]. Synthesis and structure of [Co(bpe)2(NCS)2].CH3OH, [Co(bpe)2(H2O)2](ClO4)2.2CH3OH and [Co(bpe)2(H2O)2(CH3OH)2](ClO4)2.bpe.H2O New Journal of Chemistry (2001)
Space group: I 41 c d
Cell volume: 6271
Cell parameters: 19.49; 19.49; 16.508; 90; 90; 90;  

COD ID: 7053186
CIF file Formula: - C37 H30 F6 N5 O1.5 P2 Ru -
Comments: Sylvain, Rémy; Vendier, Laure; Bijani, Christian; Santoro, Antonio; Puntoriero, Fausto; Campagna, Sebastiano; Sutra, Pierre; Igau, Alain Evidence of the unprecedented conversion of intermolecular proton to water bridging of two phosphoryl ruthenium complexes New Journal of Chemistry 37(11) (2013) 3543
Space group: I 41 c d
Cell volume: 13787.2
Cell parameters: 28.4278; 28.4278; 17.0604; 90; 90; 90;  

COD ID: 7054061
CIF file Formula: - C91 H108 Cl5 Fe8 N59 O30 S11 -
Comments: Abhervé, Alexandre; Clemente-Juan, Juan Modesto; Clemente-León, Miguel; Coronado, Eugenio; Boonmak, Jaursup; Youngme, Sujittra Tuning the nuclearity of iron(iii) polynuclear clusters by using tetradentate Schiff-base ligands New Journal of Chemistry 38(5) (2014) 2105
Space group: I 41 c d
Cell volume: 33671.1
Cell parameters: 28.5279; 28.5279; 41.3731; 90; 90; 90;  

COD ID: 7056045
CIF file Formula: - C27 H28 N4 O10 Zn2 -
Comments: Altaf, Muhammad; Mansha, Muhammad; Sohail, Manzar; Isab, Anvarhusein A.; Ullah, Nisar; Khan, Safyan A.; Sher, Muhammad; Stoeckli-Evans, Helen Synthesis, structures and photoluminescence properties of mixed ligand divalent metal‒organic frameworks New J. Chem. 41(8) (2017) 2980
Space group: I 41 c d
Cell volume: 5578.7
Cell parameters: 13.894; 13.894; 28.8987; 90; 90; 90;  

COD ID: 7061944
CIF file Formula: - C14 H20 F6 N2 O Pd -
Comments: Xu, Songsong; Shao, Yingbo; Zheng, Hanliang; Leng, Xuebing; Xue, Xiao-Song; Shen, Qilong Preparation, characterization and reactivity of trifluoromethoxy palladium(ii) complexes New Journal of Chemistry 46(43) (2022) 20760-20767
Space group: I 41 c d
Cell volume: 6937.7
Cell parameters: 22.1489; 22.1489; 14.1421; 90; 90; 90;  

COD ID: 7104020
CIF file Formula: - C10 H14 N4 -
Comments: Boldog, Ishtvan; Rusanov, Eduard B.; Sieler, Joachim; Blaurock, Steffen; Domasevitch, Konstantin V. Construction of extended networks with a trimeric pyrazole synthon Chemical Communications (Cambridge, United Kingdom) (issue 6) (2003) 740-741
Space group: I 41 c d
Cell volume: 6562.5
Cell parameters: 27.619; 27.619; 8.6029; 90; 90; 90;  

COD ID: 7107201
CIF file Formula: - C24 H15 Co N2 O4.5 -
Comments: Jinhee Park; Jian-Rong Li; E. Carolina Sanudo; Daqiang Yuan; Hong-Cai Zhou A porous metal-organic framework with helical chain building units exhibiting facile transition from micro- to meso-porosity Chem.Commun. 48 (2012) 883
Space group: I 41 c d
Cell volume: 27103
Cell parameters: 23.394; 23.394; 49.524; 90; 90; 90;  

COD ID: 7107334
CIF file Formula: - C32 H22 F10 Ir N8 P -
Comments: Guogang Shan; Haibin Li; Hong-Tao Cao; Dong-Xia Zhu; Zhong-Min Su; Yi Liao Reversible piezochromic behavior of two new cationic iridium(III) complexes Chem.Commun. 48 (2012) 2000
Space group: I 41 c d
Cell volume: 14217
Cell parameters: 18.452; 18.452; 41.756; 90; 90; 90;  

COD ID: 7120490
CIF file Formula: - C161 H151 Ca N35 O35 -
Comments: Mateus, Pedro; Wicher, Barbara; Ferrand, Yann; Huc, Ivan Alkali and alkaline earth metal ion binding by a foldamer capsule: selective recognition of magnesium hydrate Chem. Commun. (2017)
Space group: I 41 c d
Cell volume: 34004
Cell parameters: 21.7945; 21.7945; 71.588; 90; 90; 90;  

COD ID: 7125486
CIF file Formula: - C10 H12 N3 Ni0.5 O7 -
Comments: Blake, A. J.; Brett, M. T.; Champness, N. R.; Khlobystov, A. N.; Long, D. L.; Wilson, C.; Schröder, M Inorganic-organic interpenetrating frameworks: 4,4'-bipyridine N,N'-dioxide as a bridging hydrogen-bond acceptor. Chemical communications (Cambridge, England) (issue 21) (2001) 2258-2259
Space group: I 41 c d
Cell volume: 5006.2
Cell parameters: 19.3091; 19.3091; 13.4271; 90; 90; 90;  

COD ID: 7126972
CIF file Formula: - C30 H56 B2 Cl2 N6 -
Comments: Fırıncı, Erkan; Fırıncı, Rukiye; Sevinçek, Resul; Aygün, Muhittin; Şahin, Yüksel Neutral cyclic sp<sup>2</sup>-sp<sup>3</sup> and sp<sup>3</sup>-sp<sup>3</sup> diboranes from <i>N</i>,<i>N</i>'-dicyclohexylcarbodiimide insertion into 1,2-dichlorodiboranes(4). Chemical communications (Cambridge, England) 56(68) (2020) 9807-9810
Space group: I 41 c d
Cell volume: 7634.7
Cell parameters: 17.638; 17.638; 24.541; 90; 90; 90;  

COD ID: 7130878
CIF file Formula: - C26 H72 N5 Si8 Yb -
Comments: Li, Yangjuan; Gong, Yu Nitrile formation via dichlorocarbene insertion into the Si-N bond of Ln(III) bis(trimethylsilyl)amide complexes Chemical Communications (2022)
Space group: I 41 c d
Cell volume: 9430.1
Cell parameters: 20.0586; 20.0586; 23.4376; 90; 90; 90;  

COD ID: 7151748
CIF file Formula: - C11 H5 F4 N O -
Comments: Ponce González, Julia; Edgar, Mark; Elsegood, Mark R. J.; Weaver, George W. Synthesis of fluorinated fused benzofurans and benzothiophenes: Smiles-type rearrangement and cyclisation of perfluoro(het)aryl ethers and sulfides. Organic & biomolecular chemistry 9(7) (2011) 2294-2305
Space group: I 41 c d
Cell volume: 3971.9
Cell parameters: 13.0912; 13.0912; 23.1759; 90; 90; 90;  

COD ID: 7155911
CIF file Formula: - C9 H9 N O S -
Comments: Urriolabeitia, Esteban Pablo; Ruiz, Sara; Carrera, Clara; Villuendas, Pedro Ru-catalysed synthesis of fused heterocycle-pyridinones and -pyrones Org. Biomol. Chem. (2017)
Space group: I 41 c d
Cell volume: 7025
Cell parameters: 14.6413; 14.6413; 32.7707; 90; 90; 90;  

COD ID: 7156690
CIF file Formula: - C31.25 H29.5 Cl0.5 F6 N2 P S2 -
Comments: Joo, Wontae; Bielawski, Christopher W. Design, synthesis and study of a photochromic α,ω-diene: toward new classes of photoswitchable polymers. Organic & biomolecular chemistry 17(9) (2019) 2486-2491
Space group: I 41 c d
Cell volume: 12517.7
Cell parameters: 39.9997; 39.9997; 7.8237; 90; 90; 90;  

COD ID: 7206207
CIF file Formula: - C2 Cl3 N -
Comments: Olejniczak, Anna; Katrusiak, Andrzej Structure–property relations in chloroacetonitriles CrystEngComm 13(16) (2011) 5212
Space group: I 41 c d
Cell volume: 1889.1
Cell parameters: 15.251; 15.251; 8.1219; 90; 90; 90;  

COD ID: 7208732
CIF file Formula: - C32 H28 Br2 N4 Ni -
Comments: Kounavi, Konstantina A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Supramolecular patterns of cationic and neutral Ni(ii) complexes from the interplay of hydrogen-bonding, stacking interactions and metal-coordination motifs CrystEngComm 14(20) (2012) 6492
Space group: I 41 c d
Cell volume: 11574
Cell parameters: 28.6711; 28.6711; 14.0797; 90; 90; 90;  

COD ID: 7211567
CIF file Formula: - C70 H140 Mn Mo6 N5 O28 -
Comments: Song, Yu-Fei; Long, De-Liang; Cronin, Leroy Hybrid polyoxometalate clusters with appended aromatic platforms CrystEngComm 12(1) (2010) 109
Space group: I 41 c d
Cell volume: 37318.9
Cell parameters: 31.8004; 31.8004; 36.9032; 90; 90; 90;  

COD ID: 7213143
CIF file Formula: - C10 H8 N8 -
Comments: Bethel, Paul A.; Hill, Michael S.; Mahon, Mary F.; Molloy, Kieran C. Reactions of organotin tetrazoles: synthesis of functionalised poly-tetrazoles Journal of the Chemical Society, Perkin Transactions 1 (issue 23) (1999) 3507
Space group: I 41 c d
Cell volume: 4227.2
Cell parameters: 24.513; 24.513; 7.035; 90; 90; 90;  

COD ID: 7223084
CIF file Formula: - C56 H86 F2 Li2 N3 O4 Si2 Y -
Comments: Wang, Chao; Huang, Ling ling; Lu, Min; Zhao, Bei; Wang, Yaorong; Zhang, Yong; Shen, Qi; Yao, Yingming Anionic phenoxy-amido rare-earth complexes as efficient catalysts for amidation of aldehydes with amines RSC Adv. (2015)
Space group: I 41 c d
Cell volume: 12100
Cell parameters: 21.1754; 21.1754; 26.984; 90; 90; 90;  

COD ID: 7223085
CIF file Formula: - C56 H86 F2 Li2 N3 O4 Si2 Yb -
Comments: Wang, Chao; Huang, Ling ling; Lu, Min; Zhao, Bei; Wang, Yaorong; Zhang, Yong; Shen, Qi; Yao, Yingming Anionic phenoxy-amido rare-earth complexes as efficient catalysts for amidation of aldehydes with amines RSC Adv. (2015)
Space group: I 41 c d
Cell volume: 12084.4
Cell parameters: 21.1739; 21.1739; 26.954; 90; 90; 90;  

COD ID: 7223086
CIF file Formula: - C56 H86 F2 Li2 N3 O4 Si2 Sm -
Comments: Wang, Chao; Huang, Ling ling; Lu, Min; Zhao, Bei; Wang, Yaorong; Zhang, Yong; Shen, Qi; Yao, Yingming Anionic phenoxy-amido rare-earth complexes as efficient catalysts for amidation of aldehydes with amines RSC Adv. (2015)
Space group: I 41 c d
Cell volume: 12235.8
Cell parameters: 21.2389; 21.2389; 27.125; 90; 90; 90;  

COD ID: 7223087
CIF file Formula: - C56 H86 F2 Li2 N3 Nd O4 Si2 -
Comments: Wang, Chao; Huang, Ling ling; Lu, Min; Zhao, Bei; Wang, Yaorong; Zhang, Yong; Shen, Qi; Yao, Yingming Anionic phenoxy-amido rare-earth complexes as efficient catalysts for amidation of aldehydes with amines RSC Adv. (2015)
Space group: I 41 c d
Cell volume: 12289.7
Cell parameters: 21.2689; 21.2689; 27.1676; 90; 90; 90;  

COD ID: 7223088
CIF file Formula: - C56 H86 Cl2 Li2 N3 O4 Si2 Sm -
Comments: Wang, Chao; Huang, Ling ling; Lu, Min; Zhao, Bei; Wang, Yaorong; Zhang, Yong; Shen, Qi; Yao, Yingming Anionic phenoxy-amido rare-earth complexes as efficient catalysts for amidation of aldehydes with amines RSC Adv. (2015)
Space group: I 41 c d
Cell volume: 12405.3
Cell parameters: 21.5582; 21.5582; 26.692; 90; 90; 90;  

COD ID: 7223089
CIF file Formula: - C56 H86 Cl2 Li2 N3 Nd O4 Si2 -
Comments: Wang, Chao; Huang, Ling ling; Lu, Min; Zhao, Bei; Wang, Yaorong; Zhang, Yong; Shen, Qi; Yao, Yingming Anionic phenoxy-amido rare-earth complexes as efficient catalysts for amidation of aldehydes with amines RSC Adv. (2015)
Space group: I 41 c d
Cell volume: 12667.7
Cell parameters: 21.6935; 21.6935; 26.9178; 90; 90; 90;  

COD ID: 7223090
CIF file Formula: - C56 H86 Br2 Li2 N3 O4 Si2 Sm -
Comments: Wang, Chao; Huang, Ling ling; Lu, Min; Zhao, Bei; Wang, Yaorong; Zhang, Yong; Shen, Qi; Yao, Yingming Anionic phenoxy-amido rare-earth complexes as efficient catalysts for amidation of aldehydes with amines RSC Adv. (2015)
Space group: I 41 c d
Cell volume: 12459.8
Cell parameters: 21.6583; 21.6583; 26.562; 90; 90; 90;  

COD ID: 7223091
CIF file Formula: - C56 H86 Br2 Li2 N3 Nd O4 Si2 -
Comments: Wang, Chao; Huang, Ling ling; Lu, Min; Zhao, Bei; Wang, Yaorong; Zhang, Yong; Shen, Qi; Yao, Yingming Anionic phenoxy-amido rare-earth complexes as efficient catalysts for amidation of aldehydes with amines RSC Adv. (2015)
Space group: I 41 c d
Cell volume: 12521
Cell parameters: 21.6873; 21.6873; 26.622; 90; 90; 90;  

COD ID: 7225246
CIF file Formula: - C30 H38 O8 -
Comments: Greatorex, Sam; Halcrow, Malcolm A. Highly porous hydrogen-bond networks from a triptycene-based catechol CrystEngComm 18(25) (2016) 4695
Space group: I 41 c d
Cell volume: 5513.96
Cell parameters: 13.3213; 13.3213; 31.0721; 90; 90; 90;  

COD ID: 7226532
CIF file Formula: - C14 H16 Cd N2 O6 -
Comments: Karmakar, Anirban; Rúbio, Guilherme M. D. M.; Guedes da Silva, M. Fátima C.; Ribeiro, Ana; Pombeiro, Armando J. L. ZnII and CdII MOFs based on Amidoisophthalic acid ligand: Synthesis, Structure and Catalytic Application in Transesterification RSC Adv. (2016)
Space group: I 41 c d
Cell volume: 6399.6
Cell parameters: 24.9839; 24.9839; 10.2525; 90; 90; 90;  

COD ID: 7229863
CIF file Formula: - C23 H23 N5 O7 Zn -
Comments: Chisca, Diana; Croitor, Lilia; Petuhov, Oleg; Kulikova, Olga V.; Volodina, Galina F.; Coropceanu, Eduard B.; Masunov, Artëm E.; Fonari, Marina S. Tuning structures and emissive properties in a series of Zn(ii) and Cd(ii) coordination polymers containing dicarboxylic acids and nicotinamide pillars CrystEngComm 20(4) (2018) 432
Space group: I 41 c d
Cell volume: 9191.6
Cell parameters: 17.9994; 17.9994; 28.3709; 90; 90; 90;  

COD ID: 7229866
CIF file Formula: - C23 H23 Cd N5 O7 -
Comments: Chisca, Diana; Croitor, Lilia; Petuhov, Oleg; Kulikova, Olga V.; Volodina, Galina F.; Coropceanu, Eduard B.; Masunov, Artëm E.; Fonari, Marina S. Tuning structures and emissive properties in a series of Zn(ii) and Cd(ii) coordination polymers containing dicarboxylic acids and nicotinamide pillars CrystEngComm 20(4) (2018) 432
Space group: I 41 c d
Cell volume: 9717.1
Cell parameters: 18.3535; 18.3535; 28.847; 90; 90; 90;  

COD ID: 7233100
CIF file Formula: - C4 H16 Br1.052 Cl0.948 Co N4 O4 -
Comments: Vušak, Darko; Smrečki, Neven; Prugovečki, Biserka; Đilović, Ivica; Kirasić, Inka; Žilić, Dijana; Muratović, Senada; Matković-Čalogović, Dubravka Cobalt, nickel and copper complexes with glycinamide: structural insights and magnetic properties RSC Advances 9(38) (2019) 21637
Space group: I 41 c d
Cell volume: 4954.9
Cell parameters: 11.3708; 11.3708; 38.3225; 90; 90; 90;  

COD ID: 7233102
CIF file Formula: - C4 H16 Br0.937 Cl1.063 N4 Ni O4 -
Comments: Vušak, Darko; Smrečki, Neven; Prugovečki, Biserka; Đilović, Ivica; Kirasić, Inka; Žilić, Dijana; Muratović, Senada; Matković-Čalogović, Dubravka Cobalt, nickel and copper complexes with glycinamide: structural insights and magnetic properties RSC Advances 9(38) (2019) 21637
Space group: I 41 c d
Cell volume: 4878
Cell parameters: 11.3175; 11.3175; 38.0842; 90; 90; 90;  

COD ID: 7233108
CIF file Formula: - C4 H16 Cl2 N4 Ni O4 -
Comments: Vušak, Darko; Smrečki, Neven; Prugovečki, Biserka; Đilović, Ivica; Kirasić, Inka; Žilić, Dijana; Muratović, Senada; Matković-Čalogović, Dubravka Cobalt, nickel and copper complexes with glycinamide: structural insights and magnetic properties RSC Advances 9(38) (2019) 21637
Space group: I 41 c d
Cell volume: 4749
Cell parameters: 11.2394; 11.2394; 37.594; 90; 90; 90;  

COD ID: 7233110
CIF file Formula: - C4 H16 Cl2 Co N4 O4 -
Comments: Vušak, Darko; Smrečki, Neven; Prugovečki, Biserka; Đilović, Ivica; Kirasić, Inka; Žilić, Dijana; Muratović, Senada; Matković-Čalogović, Dubravka Cobalt, nickel and copper complexes with glycinamide: structural insights and magnetic properties RSC Advances 9(38) (2019) 21637
Space group: I 41 c d
Cell volume: 4861.29
Cell parameters: 11.3145; 11.3145; 37.9735; 90; 90; 90;  

COD ID: 7238450
CIF file Formula: - C30 H26 Co N12 O4 -
Comments: Hu, Tuoping; Zhao, Xiaoliang; Hu, Xiaoqin; Xu, Yumin; Sun, Di; Sun, Daofeng Two novel isomeric organic anion-water aggregations: 1D tape and 3D 2-fold interpenetrated diamond network RSC Advances 1(9) (2011) 1682
Space group: I 41 c d
Cell volume: 6427.2
Cell parameters: 16.2028; 16.2028; 24.4818; 90; 90; 90;  

COD ID: 7239639
CIF file Formula: - C8 H8 Br4 Na2 O8 -
Comments: Kianimehr, Ashkan; Akhbari, Kamran; White, Jonathan; Phuruangrat, Anukorn The mechanochemical conversion of potassium coordination polymer nanostructures to interpenetrated sodium coordination polymers with halogen bond, metal‒carbon and metal‒metal interactions CrystEngComm 22(5) (2020) 888-894
Space group: I 41 c d
Cell volume: 6419.2
Cell parameters: 12.3021; 12.3021; 42.415; 90; 90; 90;  

COD ID: 7242936
CIF file Formula: - C18 H19 N O -
Comments: Bristow, Jonathan C.; Cliff, Stacey V. A.; Yang, Songjie; Wallis, John D. Interaction, bond formation or reaction between a dimethylamino group and an adjacent alkene or aldehyde group in aromatic systems controlled by remote molecular constraints CrystEngComm 23(25) (2021) 4500-4512
Space group: I 41 c d
Cell volume: 5825.07
Cell parameters: 24.7956; 24.7956; 9.4744; 90; 90; 90;  

COD ID: 7700675
CIF file Formula: - C12 H12 Mn2 N2 O13 S2 -
Comments: Luan, Lindong; Zhang, Ying; Zeng, Hongmei; Zou, Guohong; Dai, Yong; Zhou, Xiaoying; Lin, Zhien Cluster-oxalate frameworks with extra-large channels: solvent-free synthesis, chemical stability, and proton conduction. Dalton transactions (Cambridge, England : 2003) 48(35) (2019) 13130-13134
Space group: I 41 c d
Cell volume: 7039.01
Cell parameters: 23.10844; 23.10844; 13.18166; 90; 90; 90;  

COD ID: 7703483
CIF file Formula: - C18 H40 Co2 Dy3 N4 Na O33 -
Comments: Lun, Hui-Jie; Kong, Xiang-Jian; Long, La-Sheng; Zheng, Lan-Sun Trigonal bipyramidal CoDy<sub>3</sub> cluster exhibiting single-molecule magnet behavior. Dalton transactions (Cambridge, England : 2003) 49(8) (2020) 2421-2425
Space group: I 41 c d
Cell volume: 16555.1
Cell parameters: 25.3027; 25.3027; 25.8582; 90; 90; 90;  

COD ID: 7708706
CIF file Formula: - C24 H30 N16 O Ru2 -
Comments: Lahiri, Goutam Kumar; Bera, Sudip Kumar Structural and electronic forms of doubly oxido/Pz and triply oxido/(Pz)2 bridged mixed valent and isovalent diruthenium complexes (Pz=Pyrazolate) Dalton Transactions (2021)
Space group: I 41 c d
Cell volume: 13467.5
Cell parameters: 29.6769; 29.6769; 15.2915; 90; 90; 90;  

COD ID: 7709332
CIF file Formula: - C59 H99 Mo12 N8 O40 P Zn4 -
Comments: Zhu, Yinhua; Yang, Jianbo; Liu, Xiaomei; Wang, Jilei; Ping, Qingdong; Du, Zeyu; Li, Jianian; Zang, Tingting; Mei, Hua; Xu, Yan Two POM-based compounds containing Zn-capped Keggin anions as decent heterogeneous catalysts for sulfur oxidation and cycloaddition of CO2 reactions Dalton Transactions (2022)
Space group: I 41 c d
Cell volume: 36512
Cell parameters: 32.635; 32.635; 34.282; 90; 90; 90;  

COD ID: 7713711
CIF file Formula: - C16 H29 Al K N2 P -
Comments: Vrána, Jan; Ruzickova, Zdenka; R°užička, Aleš; Dostál, Libor Synthesis and reactivity of alkali metal aluminates bearing bis(organoamido)phosphane ligand Dalton Transactions (2023)
Space group: I 41 c d
Cell volume: 8310.6
Cell parameters: 24.319; 24.319; 14.0521; 90; 90; 90;  

COD ID: 7714869
CIF file Formula: - C12 H12 Co0.13 N8 Zn1.87 -
Comments: Lopresti, Mattia; Kurowski, Łukasz; Palin, Luca; Milanesio, Marco; Siedzielnik, Magdalena; Gutmańska, Karolina; Dobrenko, Adriana; Klimczuk, Tomasz; Pawelczyk, Ewelina; Dołęga, Anna New heterometallic Co/Zn, Ag/Co, and Ag/Zn imidazolates: structural characterization and catalytic activity in the oxidation of organic compounds. Dalton transactions (Cambridge, England : 2003) 53(6) (2024) 2833-2847
Space group: I 41 c d
Cell volume: 6909.6
Cell parameters: 23.5344; 23.5344; 12.4751; 90; 90; 90;  

COD ID: 7717902
CIF file Formula: - C27 H56 B N3 Sn2 -
Comments: Dotzauer, Simon; Kar, Sourav; Swoboda, Theresa; Weidemann, Christoph; Häfner, Andreas; Dewhurst, Rian D.; Braunschweig, Holger Synthesis of base-free boriranes and their conversion to borirenes using strong reductant. Dalton transactions (Cambridge, England : 2003) 54(9) (2025) 3857-3862
Space group: I 41 c d
Cell volume: 6147.1
Cell parameters: 16.7432; 16.7432; 21.9277; 90; 90; 90;  

COD ID: 8105240
CIF file Formula: - C20 H36 Cl4 N4 O2 Pd2 S2 -
Comments: Ha, Kwang Crystal structure of cyclo-[tetrachlorido-bis(μ2-p-xylylenediamine-κ2 N:N′)dipalladium(II)] dimethyl sulfoxide solvate, C20H36Cl4N4O2Pd2S2 Zeitschrift für Kristallographie - New Crystal Structures 235(3) (2020) 629-630
Space group: I 41 c d
Cell volume: 5912.1
Cell parameters: 17.3126; 17.3126; 19.725; 90; 90; 90;  

COD ID: 9011049
CIF file Formula: - B4 Li2 O7 -
Comments: Krogh-Moe J The crystal structure of lithium diborate, Li2O*2B2O3 Acta Crystallographica 15 (1962) 190-193
Space group: I 41 c d
Cell volume: 920.126
Cell parameters: 9.47; 9.47; 10.26; 90; 90; 90;  


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