Crystallography Open Database
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1001370 | CIF | Li2 O6 Te Zr | R 3 :H | 5.172; 5.172; 13.847 90; 90; 120 | 320.8 | Choisnet, J; Rulmont, A; Tarte, P Les tellurates mixtes Li~2~ Zr Te O~6~ et Li~2~ Hf Te O~6~: un nouveau phenomene d'ordre dans la famille corindon Journal of Solid State Chemistry, 1988, 75, 124-135 |
1001502 | CIF | Li2 O6 Te Zr | R 3 :H | 5.172; 5.172; 13.847 90; 90; 120 | 320.8 | Archaimbault, F; Choisnet, J; Rulmont, A; Tarte, P Lithium defect and ordering phenomena in the new LiNbO~3~ like mixed tellurates: Li~2-x~(Zr^4+^,Nb^5+^,Te^6+^)~2~O~6~ (x<0.5) Materials Chemistry and Physics, 1992, 30, 245-252 |
1001503 | CIF | Li2 O6 Te Zr | R 3 :H | 5.1732; 5.1732; 13.8508 90; 90; 120 | 321 | Archaimbault, F; Choisnet, J; Rulmont, A; Tarte, P Lithium defect and ordering phenomena in the new LiNbO~3~ like mixed tellurates: Li~2-x~(Zr^4+^,Nb^5+^,Te^6+^)~2~O~6~ (x<0.5) Materials Chemistry and Physics, 1992, 30, 245-252 |
1001504 | CIF | Li1.75 Nb0.25 O6 Te Zr0.75 | R 3 :H | 5.167; 5.167; 13.795 90; 90; 120 | 319 | Archaimbault, F; Choisnet, J; Rulmont, A; Tarte, P Lithium defect and ordering phenomena in the new LiNbO~3~ like mixed tellurates: Li~2-x~(Zr^4+^,Nb^5+^,Te^6+^)~2~O~6~ (x<0.5) Materials Chemistry and Physics, 1992, 30, 245-252 |
1005011 | CIF | Li Mo N2 | R 3 :H | 2.8674; 2.8674; 15.801 90; 90; 120 | 112.5 | Elder, S H; Doerrer, L H; DiSalvo, F J; Parise, J B; Guyomard, D; Tarascon, J M LiMoN~2~: the first metallic layered nitride Chemistry of Materials (1,1989-, 1992, 4, 928-937 |
1007246 | CIF | As5 Fe12 | R 3 :H | 6.7855; 6.7855; 16.30099 90; 90; 120 | 650 | Maaref, S; Maddar, R; Chaudouet, P; Fruchart, R; Senateur, J P; Averbuch-Pouchot, M T; Bacmann, M; Durif, A; Wolfers, P Etude de la structure et des conditions de stabilite d'un nouvel arseniure de fer: Fe12 As5 Materials Research Bulletin, 1983, 18, 473-480 |
1007265 | CIF | As5 Fe10.77 Ru1.23 | R 3 :H | 6.8234; 6.8234; 16.364 90; 90; 120 | 659.8 | Maaref, S; Madar, R; Chaudouet, P; Fruchart, R; Senateur, J P; Averbuch-Pouchot, M T; Bacmann, M; Durif, A; Wolfers, P Etude des la structure et des conditions de stabilite d'un nouvel arseniure de fer: Fe12 As5 Materials Research Bulletin, 1983, 18, 473-480 |
1010457 | CIF | S Tl2 | R 3 :H | 12.2; 12.2; 18.17 90; 90; 120 | 2342.1 | Ketelaar, J A A; Gorter, E W Die Kristallstruktur des Thallosulfid ( Tl~2~ S ) Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1939, 101, 367-375 |
1100103 | CIF | H12 Mg O9 S | R 3 :H | 8.83; 8.83; 9.075 90; 90; 120 | 612.8 | Flack, H Etude de la structure cristalline du sulfite de magnesium hexahydrate, Mg S O3 (H2 O)6 Acta Crystallographica B (24,1968-38,1982), 1973, 29, 656-658 |
1100179 | CIF | C18 H22 O | R 3 :H | 23.056; 23.056; 7.325 90; 90; 120 | 3372.15 | Bromm, Lars O.; Laaziri, Hamid; Lhermitte, Frédéric; Harms, Klaus; Knochel, Paul Highly Regio- and Stereoselective Thermal Migration of Organoboranes in Acyclic Molecules Journal of the American Chemical Society, 2000, 122, 10218-10219 |
1100180 | CIF | C17 H20 O | R 3 :H | 22.864; 22.864; 7.229 90; 90; 120 | 3272.75 | Bromm, Lars O.; Laaziri, Hamid; Lhermitte, Frédéric; Harms, Klaus; Knochel, Paul Highly Regio- and Stereoselective Thermal Migration of Organoboranes in Acyclic Molecules Journal of the American Chemical Society, 2000, 122, 10218-10219 |
1100187 | CIF | C22.17 H35.34 Cl0.34 N O4 | R 3 :H | 28.224; 28.224; 15.262 90; 90; 120 | 10528.8 | Bach, Thorsten; Bergmann, Hermann; Grosch, Benjamin; Harms, Klaus; Herdtweck, Eberhardt Synthesis of Enantiomerically Pure 1,5,7-Trimethyl-3-azabicyclo[3.3.1]nonan-2-ones as Chiral Host Compounds for Enantioselective Photochemical Reactions in Solution Synthesis, 2001, 2001, 1395-1405 |
1502521 | CIF | C21 H24 N2 O4 | R 3 :H | 19.502; 19.502; 13.648 90; 90; 120 | 4495 | Guo, Shengmei; Xie, Yinjun; Hu, Xinquan; Huang, Hanmin Highly diastereo- and enantioselective tandem reaction toward functionalized pyrrolidines with multiple stereocenters. Organic letters, 2011, 13, 5596-5599 |
1503706 | CIF | C27.667 H35.667 N O10.667 | R 3 :H | 19.2969; 19.2969; 19.1134 90; 90; 120 | 6163.7 | Ismail, Intan Safinar; Nagakura, Yuta; Hirasawa, Yusuke; Hosoya, Takahiro; Lazim, Mohd Izwan Mohd; Lajis, Nordin Hj; Shiro, Motoo; Morita, Hiroshi Chrotacumines A-D, chromone alkaloids from Dysoxylum acutangulum. Journal of natural products, 2009, 72, 1879-1883 |
1504071 | CIF | C17 H22 Br N3 O5 | R 3 :H | 21.619; 21.619; 12.828 90; 90; 120 | 5192.3 | Cheng, Liang; Liu, Li; Wang, Dong; Chen, Yong-Jun Highly enantioselective and organocatalytic alpha-amination of 2-oxindoles. Organic letters, 2009, 11, 3874-3877 |
1505488 | CIF | C16 H20 N O5.5 | R 3 :H | 16.3003; 16.3003; 29.5212 90; 90; 120 | 6792.9 | Banwell, Martin G.; Kokas, Okanya J.; Willis, Anthony C. Chemoenzymatic approaches to the montanine alkaloids: a total synthesis of (+)-brunsvigine. Organic letters, 2007, 9, 3503-3506 |
1506242 | CIF | C42 H56 Cl2 N4 O12 | R 3 :H | 27.991; 27.991; 20.057 90; 90; 120 | 13609 | Hong, Wen-Xu; Chen, Ling-Jun; Zhong, Chun-Long; Yao, Zhu-Jun Bidirectional synthesis of the central amino acid of chloptosin. Organic letters, 2006, 8, 4919-4922 |
1507134 | CIF | B3 H12 K Zn | R 3 :H | 7.6291; 7.6291; 10.977 90; 90; 120 | 553.3 | Černý, Radovan; Ravnsbæk, Dorthe B.; Schouwink, Pascal; Filinchuk, Yaroslav; Penin, Nicolas; Teyssier, Jeremie; Smrčok, L'ubomír; Jensen, Torben R. Potassium Zinc Borohydrides Containing Triangular [Zn(BH4)3]−and Tetrahedral [Zn(BH4)xCl4‒x]2‒Anions The Journal of Physical Chemistry C, 2012, 116, 1563 |
1507949 | CIF | C24 H52.33 Br Cl2 N5 O2.33 P2 Ru | R 3 :H | 28.71; 28.71; 10.909 90; 90; 120 | 7787 | Tulchinsky, Yuri; Iron, Mark A.; Botoshansky, Mark; Gandelman, Mark Nitrenium ions as ligands for transition metals. Nature chemistry, 2011, 3, 525-531 |
1508049 | CIF | C48 H78 Fe N2 Na O3 P3 Si | R 3 :H | 17.9312; 17.9312; 13.1252 90; 90; 120 | 3654.73 | Lee, Yunho; Mankad, Neal P.; Peters, Jonas C. Triggering N(2) uptake via redox-induced expulsion of coordinated NH(3) and N(2) silylation at trigonal bipyramidal iron. Nature chemistry, 2010, 2, 558-565 |
1508893 | CIF | C98 H156 F24 N22 Na4 O27 P4 | R 3 :H | 16.382; 16.382; 39.89 90; 90; 120 | 9271 | Izzo, Irene; Ianniello, Graziella; De Cola, Chiara; Nardone, Brunello; Erra, Loredana; Vaughan, Gavin; Tedesco, Consiglia; De Riccardis, Francesco Structural effects of proline substitution and metal binding on hexameric cyclic peptoids. Organic letters, 2013, 15, 598-601 |
1510571 | CIF | Au5 Sn | R 3 :H | 5.092; 5.092; 14.333 90; 90; 120 | 321.843 | Yamaguchi, S.; Hirabayashi, M.; Osada, K. An ordered stucture of Au5 Sn Transactions of the Japan Institute of Metals, 1974, 15, 256-260 |
1512780 | CIF | C18 H12 Co3 N15 O4 P | R 3 :H | 22.202; 22.202; 4.3536 90; 90; 120 | 1858.5 | Kari Darling; Jon Zubieta Solid state coordination chemistry of metal-azolate compounds: Structural consequences of incorporation of phosphate components in the Co(II)/4-pyridyltetrazolate/phosphate system Inorganica Chimica Acta, 2013, 394, 512-518 |
1521214 | CIF | Cr2 D3.804 Zr | R 3 :H | 9.3848; 9.3848; 26.5461 90; 90; 120 | 2024.8 | Irodova, A.V.; Suard, E. Order-disorder phase transition in the deuterated hexagonal (C14-type) Laves phase Zr Cr2 D3.8 Journal of Alloys Compd., 2000, 299, 32-38 |
1521824 | CIF | Ca2.1 Ce1.15 Cl0.17 F0.28 Fe0.15 H4.32 Hf0.05 K0.1 Mn3.6 Na16 Nb0.4 O77.11 Si25.6 Sr0.45 Ti0.1 Zr3.3 | R 3 :H | 14.182; 14.182; 30.37 90; 90; 120 | 5289.94 | Rastsvetaeva, R.K.; Khomyakov, A.P.; Nekrasov, Yu.V. Crystal structure of a novel analog of eudialyte with R3 symmetry Kristallografiya, 1999, 44, 824-828 |
1522207 | CIF | Ge Li2 O6 Te | R 3 :H | 5.00795; 5.00795; 14.3422 90; 90; 120 | 311.506 | Woodward, P.M.; Du, L.-S.; Sleight, A.W.; Grey, C.P. Structural studies and order-disorder phenomenon in a series of new quaternary tellurates of the type A(2+) M(4+) Te(6+) O6 and A(1+)2 M(4+) Te(6+) O6 Journal of Solid State Chemistry, 1999, 147, 99-116 |
1522962 | CIF | Ga4 Pd7 Zn3 | R 3 :H | 11.531; 11.531; 5.249 90; 90; 120 | 604.423 | Subrahmanyam, A.V.; Schubert, K. Ueber die Mischung P Zn - Pd Ga Journal of the Less-Common Metals, 1973, 32, 199-206 |
1525784 | CIF | Rb Sb0.33 Te6 U | R 3 :H | 15.741; 15.741; 24.382 90; 90; 120 | 5231.96 | Choi, K.-S.; Kanatzidis, M.G. Unique periodic modulations in the infinite (Tex)(n-) chains of Rb U Sb0.33 Te6 Journal of Solid State Chemistry, 2001, 161, 17-22 |
1525845 | CIF | Cs2 H6 O10 S Te | R 3 :H | 7.479; 7.479; 16.637 90; 90; 120 | 805.921 | Dammak, M.; Mhiri, T.; Jaud, J.; Savariault, J.M. Structural study of the two new cesium sulfate and selenate tellurate Cs2 S O4 * Te (O H)6 and Cs2 Se O4 * Te (O H)6 International Journal of Inorganic Materials, 2001, 3, 861-873 |
1526326 | CIF | Al0.1 Ca1.77 Ce0.63 Cl0.3 Fe1.5 H5.75 K0.18 Mn2.1 Na15.99 Nb0.132 O77.6 Si25.9 Sr0.6 Ti0.168 Zr3.63 | R 3 :H | 14.205; 14.205; 30.265 90; 90; 120 | 5288.76 | Rastsvetaeva, R.K.; Khomyakov, A.P. Crystal structure of a new Mn, Na-ordered analog of eudialyte with R3 symmetry Kristallografiya, 2000, 45, 649-652 |
1526546 | CIF | K Ni O9 P3 | R 3 :H | 10.076; 10.076; 6.9623 90; 90; 120 | 612.153 | Kapshuk, A.A.; Nagornyi, P.G.; Petrenko, O.V. Synthesis, IR spectra and structures of double metaphosphates M Ni (P O3)3 (M= Na or K) Kristallografiya, 2000, 45, 238-241 |
1527653 | CIF | Fe2 P2 Se6 | R 3 :H | 6.265; 6.265; 19.8 90; 90; 120 | 673.036 | Klingen, W.; Hahn, H.; Eulenberger, G. Ueber die Kristallstrukturen von Fe2 P2 Se6 und Fe2 P2 S6 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1973, 401, 97-112 |
1528809 | CIF | Ca2.4 Ce0.57 Cl0.35 Fe1.2 H2.89 K0.18 Mn3.51 Na13.56 Nb0.43 O3.76 Si0.46 Ti0.06 Zr3 | R 3 :H | 14.134; 14.134; 30.178 90; 90; 120 | 5220.97 | Rastsvetaeva, R.K.; Rozenberg, K.A.; Moeckel, S.; Chukanov, N.V.; Pekov, I.V. Crystal structures of two new low-symmetry calcium-deficient analogs of eudialyte Kristallografiya, 2006, 51, 235-240 |
1528810 | CIF | Ca3 Ce0.33 Cl0.53 F0.66 Fe1.44 H2.62 K0.21 Mn1.44 Na15.66 Nb0.27 O4.1 Si0.9 Sr0.36 Ti0.21 Y0.09 Zr3.54 | R 3 :H | 14.192; 14.192; 30.17 90; 90; 120 | 5262.51 | Rastsvetaeva, R.K.; Rozenberg, K.A.; Moeckel, S.; Chukanov, N.V.; Pekov, I.V. Crystal structures of two new low-symmetry calcium-deficient analogs of eudialyte Kristallografiya, 2006, 51, 235-240 |
1529517 | CIF | H6 I Na O7 | R 3 :H | 6.04272; 6.04272; 13.2317 90; 90; 120 | 418.419 | Abrahams, S.C.; Bernstein, J.L. Pyroelectric Na (H3 O) (I (O H)3 O3. Room temperature crystal structure Journal of Chemical Physics, 1978, 69, 4234-4237 |
1530362 | CIF | P3 Pd7 | R 3 :H | 11.976; 11.976; 7.055 90; 90; 120 | 876.297 | Matkovic, T.; Schubert, K. Kristallstruktur von Pd7 P3 Journal of the Less-Common Metals, 1977, 55, 177-184 |
1530433 | CIF | Al1.89 As3 Fe0.19 H23 Mg2.53 Mn10.39 O34 | R 3 :H | 8.275; 8.275; 36.6 90; 90; 120 | 2170.44 | Moore, P.B.; Araki, T. Hematolite. A complex dense-packed sheet structure American Mineralogist, 1978, 63, 150-159 |
1530985 | CIF | H11.04 K6 Mn Mo9 O37.52 | R 3 :H | 15.59; 15.59; 12.44 90; 90; 120 | 2618.44 | Weakley, T.J.R. The crystal structure of potassium nonamolybdomanganate(IV) hexahydrate, K6 (Mn Mo9 O32) (H2 O)6 Journal of the Less-Common Metals, 1977, 54, 289-296 |
1531096 | CIF | Cd Cs N3 O6 | R 3 :H | 7.7305; 7.7305; 9.417 90; 90; 120 | 487.37 | Avdeev, M.; Kharton, V. Crystal structure of rhombohedral M Cd (N O2)3 (M = K, Rb, Cs, Tl) from X-ray powder diffraction data Materials Research Bulletin, 2002, 37, 735-743 |
1531097 | CIF | Cd N3 O6 Rb | R 3 :H | 7.629; 7.629; 9.2355 90; 90; 120 | 465.507 | Avdeev, M.; Kharton, V. Crystal structure of rhombohedral M Cd (N O2)3 (M = K, Rb, Cs, Tl) from X-ray powder diffraction data Materials Research Bulletin, 2002, 37, 735-743 |
1531098 | CIF | Cd K N3 O6 | R 3 :H | 7.5887; 7.5887; 9.1285 90; 90; 120 | 455.266 | Avdeev, M.; Kharton, V. Crystal structure of rhombohedral M Cd (N O2)3 (M = K, Rb, Cs, Tl) from X-ray powder diffraction data Materials Research Bulletin, 2002, 37, 735-743 |
1531099 | CIF | Cd N3 O6 Tl | R 3 :H | 7.6219; 7.6219; 9.23 90; 90; 120 | 464.364 | Avdeev, M.; Kharton, V. Crystal structure of rhombohedral M Cd (N O2)3 (M = K, Rb, Cs, Tl) from X-ray powder diffraction data Materials Research Bulletin, 2002, 37, 735-743 |
1531227 | CIF | Ca3 Nb1.95 O8 V0.05 | R 3 :H | 16.91; 16.91; 41.5 90; 90; 120 | 10277 | Cranswick, L.M.D.; Mumme, W.G.; Roth, R.S.; Grey, I.E.; Bordet, P. A new octahedral tilt in the perovskite phase Ca3 Nb2 O8 Journal of Solid State Chemistry, 2003, 172, 178-187 |
1532389 | CIF | C H5.2 B22 Ca6.1 Li5 Na1.6 O47 | R 3 :H | 8.99; 8.99; 35.91 90; 90; 120 | 2513.42 | Yamnova, N.A.; Egorov-Tismenko, Yu.K.; Dimitrova, O.V.; Kantor, A.P. Crystal structure of new synthetic (Ca, Na, Li)-carbonate-borate Kristallografiya, 2002, 47, 623-630 |
1532645 | CIF | As6 H24 O53 V15 Zn2 | R 3 :H | 12.0601; 12.0601; 33.97 90; 90; 120 | 4278.86 | Cui Xiaobing; Xu Jiqing; Ding Lan; Ding Hong; Yang Guoyu; Ye Ling Hydrothermal synthesis, crystal structure and characterization of (Zn (H2 O)4)2 (H2 As6 V15 O42 (H2 O)) * 2(H2 O) Journal of Molecular Structure, 2003, 660, 131-137 |
1532812 | CIF | Cr1.33 Ga2 Se5 | R 3 :H | 3.781; 3.781; 46.807 90; 90; 120 | 579.502 | Okonska-Kozlowska, I.; Szamocka, K.; Malicka, E.; Heimann, J.; Gron, T.; Mydlarz, T.; Gilewski, A.; Waskowska, A. The crystal structure and properties of Ga2 Cr1.33 Se5, a new layered semiconductor Journal of Alloys Compd., 2004, 366, 21-27 |
1534101 | CIF | C24 H29 F N2 O5 | R 3 :H | 31.82; 31.82; 6.203 90; 90; 120 | 5439.2 | Bonetti, Andrea; Pellegrino, Sara; Das, Priyadip; Yuran, Sivan; Bucci, Raffaella; Ferri, Nicola; Meneghetti, Fiorella; Castellano, Carlo; Reches, Meital; Gelmi, Maria Luisa Dipeptide Nanotubes Containing Unnatural Fluorine-Substituted β(2,3)-Diarylamino Acid and l-Alanine as Candidates for Biomedical Applications. Organic letters, 2015, 17, 4468-4471 |
1534466 | CIF | Er13 Ge6 H O32 | R 3 :H | 15.617; 15.617; 9.398 90; 90; 120 | 1985 | Genkina, E.A.; Maximov, B.A.; Dem'yanets, L.N.; Mamin, B.F. Synthesis and atomic structure of Er13 Ge6 O31 (O H) Kristallografiya, 1990, 35, 642-646 |
1534591 | CIF | K2 O9 Si3 Ti | R 3 :H | 10.0124; 10.0124; 14.8413 90; 90; 120 | 1288.48 | Lin, Z.; Ferreira, A.; Rocha, J. Synthesis and structural characterization of novel tin and titanium potassium silicates K4 M2 Si6 O18 Journal of Solid State Chemistry, 2003, 175, 258-263 |
1535209 | CIF | F3 O4 P Sn3 | R 3 :H | 11.87; 11.87; 4.69 90; 90; 120 | 572.275 | Berndt, A. F. Reaction of stannous fluoride with hydroxyapatite: The crystal structure of Sn~3PO~4~F~3~ Journal of Dental Research, 1972, 51, 53-57 |
1535828 | CIF | C Ca Ce2 F2 | R 3 :H | 7.124; 7.124; 84.1 90; 90; 120 | 3696.36 | Donnay, G.; Donnay, J.D.H. The crystallography of bastnaesite, parisite, roentgenite, and synchisite American Mineralogist, 1953, 38, 932-963 |
1535831 | CIF | C Ca2 Ce3 F3 | R 3 :H | 7.131; 7.131; 69.39999 90; 90; 120 | 3056.26 | Donnay, G.; Donnay, J.D.H. The crystallography of bastnaesite, parisite, roentgenite, and synchisite American Mineralogist, 1953, 38, 932-963 |
1536142 | CIF | In4 P6 Se18 | R 3 :H | 6.362; 6.362; 19.929 90; 90; 120 | 698.56 | Voroshilov, Yu.V.; Potorii, M.V.; Gebesh, V.Yu. Phase equilibria in In-P-Se system and crystal structure of beta - In4 (P2 Se6)3 Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy, 1991, 27, 2495-2498 |
1536329 | CIF | S42 Sr17 Ta10 | R 3 :H | 18.1525; 18.1525; 18.65739 90; 90; 120 | 5324.2 | Onoda, M.; Saeki, M.; Yajima, Y. Preparation and crystal structure model of a new strontium tantalumsulfide: Sr17 Ta10 S42 Journal of Solid State Chemistry, 1993, 105, 354-362 |
1537230 | CIF | Bi11.23 Cl12.23 Ir | R 3 :H | 12.666; 12.666; 15.86 90; 90; 120 | 2203.5 | Ruck, M.; Hampel, S. Stabilization of homonuclear Bi5(+) and Bi6(2+) polycations by cluster anions in the crystal structures of Bi12-x Ir Cl13-x, Bi12-x Rh Cl13-x and Bi12-x Rh Br13-x Polyhedron, 2002, 21, 651-656 |
1537233 | CIF | Bi11.7 Cl12.7 Rh | R 3 :H | 12.612; 12.612; 15.917 90; 90; 120 | 2192.6 | Ruck, M.; Hampel, S. Stabilization of homonuclear Bi5(+) and Bi6(2+) polycations by cluster anions in the crystal structures of Bi12-x Ir Cl13-x, Bi12-x Rh Cl13-x and Bi12-x Rh Br13-x Polyhedron, 2002, 21, 651-656 |
1537236 | CIF | Bi11.28 Br12.28 Rh | R 3 :H | 12.961; 12.961; 16.416 90; 90; 120 | 2388.22 | Ruck, M.; Hampel, S. Stabilization of homonuclear Bi5(+) and Bi6(2+) polycations by cluster anions in the crystal structures of Bi12-x Ir Cl13-x, Bi12-x Rh Cl13-x and Bi12-x Rh Br13-x Polyhedron, 2002, 21, 651-656 |
1538359 | CIF | Ni3 O6 Te | R 3 :H | 5.103; 5.103; 13.755 90; 90; 120 | 310.2 | Newnham, R.E.; Meagher, E.P. Crystal structure of Ni3 Te O6 Materials Research Bulletin, 1967, 2, 549-554 |
1540954 | CIF | Cu2.601 Mo9 S12 | R 3 :H | 5.18; 5.18; 10.33 90; 90; 120 | 240.044 | Shamrai, V.F.; Leitus, G.M.; Tandid, A.V. Crystal structure of Cu1.73 Mo6 S7.9 Soviet Physics, Crystallography (= Kristallografiya), 1987, 32, 671-673 |
1541134 | CIF | P15.99 Si9 Sn4.2 | R 3 :H | 15.665; 15.665; 8.761 90; 90; 120 | 1861.85 | Pivan, J.Y.; Guerin, P.; Padiou, J.; Sergent, M. Preparation and crystal structure of the semiconducting compound Sn4.2 Si9 P16 Journal of Solid State Chemistry, 1988, 76, 26-32 |
1541185 | CIF | Na1.65 S6 Ti3 | R 3 :H | 3.433; 3.433; 20.94 90; 90; 120 | 213.725 | Rouxel, J.; Danot, M.; Bichon, J. Les composes intercalaires Nax Ti S2. Etude structurale generale des phases Nax Ti S2 et Kx Ti S2 Bulletin de la Societe Chimique de France (Vol=Year), 1971, 1971, 3930-3935 |
1541200 | CIF | Pd8 Sb3 | R 3 :H | 7.59; 7.59; 43.2 90; 90; 120 | 2155.25 | Man, L.I.; Imamov, R.M. Crystal structure of the rhombohedral phase in the Pd-Sb system Soviet Physics, Crystallography (= Kristallografiya), 1979, 24, 365-367 |
1541283 | CIF | Al4.2 Cu3.2 Zn0.7 | R 3 :H | 4.111; 4.111; 25.036 90; 90; 120 | 366.43 | Murphy, S. The Structure of the T' Phase in the System Al-Cu-Zn Metal Science, 1975, 9, 163-168 |
1541426 | CIF | As6.3 Cu0.84 Fe H6 Mg0.1 Mn13.9 O33 Si1.7 | R 3 :H | 8.233; 8.233; 37.499 90; 90; 120 | 2201.24 | Araki, T.; Moore, P.B. Dixeneite, Cu(1+) Mn(2+)14 Fe(3+) (OH)6 (As(3+)O3)5 (Si(4+) O4)2 (As(5+) O4): metallic (As(3+)4 Cu(1+)) clusters in an oxide matrix American Mineralogist, 1981, 66, 1263-1273 |
1542874 | CIF | C18 H48 Ge Si4 | R 3 :H | 14.513; 14.513; 10.772 90; 90; 120 | 1964.9 | Hlina, Johann; Zitz, Rainer; Wagner, Harald; Stella, Filippo; Baumgartner, Judith; Marschner, Christoph σ-Bond electron delocalization of branched oligogermanes and germanium containing oligosilanes Inorganica Chimica Acta, 2014, 422, 120-133 |
1542875 | CIF | C18 H48 Ge5 | R 3 :H | 14.643; 14.643; 10.892 90; 90; 120 | 2022.5 | Hlina, Johann; Zitz, Rainer; Wagner, Harald; Stella, Filippo; Baumgartner, Judith; Marschner, Christoph σ-Bond electron delocalization of branched oligogermanes and germanium containing oligosilanes Inorganica Chimica Acta, 2014, 422, 120-133 |
1543508 | CIF | C20 H23 N O4 | R 3 :H | 19.678; 19.678; 13.192 90; 90; 120 | 4424 | Breinholt, Jens; Jensen, Helle C.; Kjaer, Anders; Olsen, Carl E.; Rassing, Birgitte R.; Rosendahl, Connie N.; Sotofte, Inger Cladobotryal: a Fungal Metabolite with a Novel Ring System Acta Chemica Scandinavica, 1998, 52, 631-634 |
1547492 | CIF | C25 H29 N O5 | R 3 :H | 19.7299; 19.7299; 30.7413 90; 90; 120 | 10363.4 | Cui, Hui; Lin, Yun; Luo, Mingchu; Lu, Yongjun; Huang, Xishan; She, Zhigang Diaporisoindoles A-C: Three Isoprenylisoindole Alkaloid Derivatives from the Mangrove Endophytic Fungus Diaporthe sp. SYSU-HQ3. Organic letters, 2017, 19, 5621-5624 |
1547614 | CIF | C25 H21 N O5 | R 3 :H | 31.8047; 31.8047; 11.8143 90; 90; 120 | 10349.5 | He, Rui; Liu, Penglin; Huo, Xiaohong; Zhang, Wanbin Ir/Zn Dual Catalysis: Enantioselective and Diastereodivergent α-Allylation of Unprotected α-Hydroxy Indanones. Organic letters, 2017, 19, 5513-5516 |
1551373 | CIF | C168 H88 N26 O18 | R 3 :H | 19.3322; 19.3322; 28.9191 90; 90; 120 | 9360 | Max J. Kory; Michael Worle; Thomas Weber; Payam Payamyar; Stan W. van de Poll; Julia Dshemuchadse; Nils Trapp; Dieter Schluter Gram-scale synthesis of two-dimensional polymer crystals and their structure analysis by X-ray diffraction Nature Chemistry, 2014, 6, 779-784 |
1551374 | CIF | C168 H88 N26 O18 | R 3 :H | 19.3695; 19.3695; 28.9712 90; 90; 120 | 9413.1 | Max J. Kory; Michael Worle; Thomas Weber; Payam Payamyar; Stan W. van de Poll; Julia Dshemuchadse; Nils Trapp; Dieter Schluter Gram-scale synthesis of two-dimensional polymer crystals and their structure analysis by X-ray diffraction Nature Chemistry, 2014, 6, 779-784 |
1551375 | CIF | C168 H88 N26 O18 | R 3 :H | 19.4976; 19.4976; 29.0508 90; 90; 120 | 9564.3 | Max J. Kory; Michael Worle; Thomas Weber; Payam Payamyar; Stan W. van de Poll; Julia Dshemuchadse; Nils Trapp; Dieter Schluter Gram-scale synthesis of two-dimensional polymer crystals and their structure analysis by X-ray diffraction Nature Chemistry, 2014, 6, 779-784 |
1551377 | CIF | C168 H88 N26 O18 | R 3 :H | 19.4393; 19.4393; 28.547 90; 90; 120 | 9342.3 | Max J. Kory; Michael Worle; Thomas Weber; Payam Payamyar; Stan W. van de Poll; Julia Dshemuchadse; Nils Trapp; Dieter Schluter Gram-scale synthesis of two-dimensional polymer crystals and their structure analysis by X-ray diffraction Nature Chemistry, 2014, 6, 779-784 |
1552639 | CIF | C44 H52 N4 O11 | R 3 :H | 30.7488; 30.7488; 14.4242 90; 90; 120 | 11810.8 | Sim, Dawn Su-Yin; Navanesan, Suerialoasan; Sim, Kae-Shin; Gurusamy, Subramaniam; Lim, Siew-Huah; Low, Yun-Yee; Kam, Toh-Seok Conolodinines A-D, Aspidosperma- Aspidosperma Bisindole Alkaloids with Antiproliferative Activity from Tabernaemontana corymbosa. Journal of natural products, 2019, 82, 850-858 |
1552766 | CIF | C28 H22 N3 P | R 3 :H | 34.841; 34.841; 5.566 90; 90; 120 | 5851.3 | Zhu, Ren-Yi; Chen, Long; Hu, Xiao-Si; Zhou, Feng; Zhou, Jian Enantioselective synthesis of <i>P</i>-chiral tertiary phosphine oxides with an ethynyl group <i>via</i> Cu(i)-catalyzed azide-alkyne cycloaddition. Chemical science, 2020, 11, 97-106 |
1553667 | CIF | C18 H16 Cl4 N4 O2 | R 3 :H | 14.7047; 14.7047; 23.9058 90; 90; 120 | 4476.6 | Zhang, Xiaohong; Shi, Jun; Shen, Guangyu; Gou, Fei; Cheng, Jinghui; Zhou, Xiangge; Xiang, Haifeng Non-conjugated fluorescent molecular cages of salicylaldehyde-based tri-Schiff bases: AIE, enantiomers, mechanochromism, anion hosts/probes, and cell imaging properties Materials Chemistry Frontiers, 2017, 1, 1041 |
1554927 | CIF | C16 H18 O | R 3 :H | 20.961; 20.961; 7.086 90; 90; 120 | 2696.2 | Lin, Minggui; Cui, Hao; Hua, Yuhui; Zhang, Yandong Domino enyne metathesis en route to skeletally diverse, privileged scaffolds: synthesis of the tricyclic core of pseudolaric acid F Organic Chemistry Frontiers, 2019, 6, 2771 |
1555598 | CIF | C19 H20 N2 O1.76 | R 3 :H | 24.3768; 24.3768; 7.2197 90; 90; 120 | 3715.4 | Rahman, M. Toufiqur; Deschamps, Jeffrey R.; Imler, Gregory H.; Schwabacher, Alan W.; Cook, James M. Total Synthesis of Macrocarpines D and E via an Enolate-Driven Copper-Mediated Cross-Coupling Process: Replacement of Catalytic Palladium with Copper Iodide. Organic letters, 2016, 18, 4174-4177 |
1557152 | CIF | C3 Ca2 K2 O9 | R 3 :H | 13.01; 13.01; 8.615 90; 90; 120 | 1262.8 | Winbo, Camilla; Bostrom, Dan; Gobbels, Matthias Crystal Structure of the Double Carbonate K2Ca2(CO3)3 Acta Chemica Scandinavica, 1997, 51, 387-391 |
1558857 | CIF | C25 H13 | R 3 :H | 25.07149; 25.07149; 11.09028 90; 90; 120 | 6037.17 | Zhu, Kaige KZ; Kamochi, Kosuke KK; Kodama, Takuya; Tobisu, Mamoru; Amaya, Toru Chiral cyclic [n]spirobifluorenylenes: carbon nanorings consisting of helically arranged quaterphenyl rods illustrating partial units of woven patterns Chemical Science, 2020 |
1558898 | CIF | Li10 N10 P4 | R 3 :H | 8.71929; 8.71929; 21.4656 90; 90; 120 | 1413.31 | Bertschler, E.-M.; Dietrich, C.; Leichtweib, T.; Janek, J.; Schnick, W. Li+ ion conductors with adamantane-type nitridophosphate anions beta-Li10P4N10 and Li13P4N10X3 with X = Cl, Br Chemistry A European Journal, 2018, 24, 196-205 |
1558984 | CIF | C87 H114 Co F3 N4 O P3 Zr | R 3 :H | 20.3878; 20.3878; 16.4288 90; 90; 120 | 5913.9 | Thomas, Christine M.; Zhang, Hongtu; Hatzis, Gregory P.; Moore, Curtis; Dickie, Diane Amanda Redox chemistry and H-atom abstraction reactivity of a terminal zirconium(IV) oxo compound mediated by an appended cobalt(I) center Chemical Science, 2020 |
1559412 | CIF | C31 H28 N4 O5 | R 3 :H | 24.2245; 24.2245; 12.4413 90; 90; 120 | 6322.8 | Wang, Jinhui; Jin, Weiyang; Zhou, Xiaoxin; Li, Jiaqi; Xu, Chengdong; Ma, Zhongjun; Wang, Jianan; Qin, Lele; Zhou, Biao; Ding, Wanjing; Gao, Tingting; Yao, Hangping; Chen, Zhe Identification, Structure‒Activity Relationships of Marine-Derived Indolocarbazoles, and a Dual PKCθ/δ Inhibitor with Potent Antipancreatic Cancer Efficacy Journal of Medicinal Chemistry, 2020 |
1561860 | CIF | O11 Pb Ta4 | R 3 :H | 6.237006; 6.237006; 36.86138 90; 90; 120 | 1241.81 | Boltersdorf, Jonathan; Maggard, Paul A. Structural and electronic investigations of PbTa4O11 and BiTa7O19 constructed from α-U3O8 types of layers Journal of Solid State Chemistry, 2015, 229, 310-321 |
1562919 | CIF | Ba Ga2 Ge S6 | R 3 :H | 9.5967; 9.5967; 8.671 90; 90; 120 | 691.58 | Lin, Xinsong; Guo, Yifeng; Ye, Ning BaGa2GeX6(X=S, Se): New mid-IR nonlinear optical crystals with large band gaps Journal of Solid State Chemistry, 2012, 195, 172-177 |
1562920 | CIF | Ba Ga2 Ge Se6 | R 3 :H | 10.0438; 10.0438; 9.114 90; 90; 120 | 796.2 | Lin, Xinsong; Guo, Yifeng; Ye, Ning BaGa2GeX6(X=S, Se): New mid-IR nonlinear optical crystals with large band gaps Journal of Solid State Chemistry, 2012, 195, 172-177 |
1564175 | CIF | C58 H52 Br2 N4 Na2 Ni4 O12 | R 3 :H | 44.4417; 44.4417; 11.323 90; 90; 120 | 19367.5 | Farwa, Ume; Pait, Moumita; Ryu, Ji Yeon; Byun, Yong Min; Lee, Seul Gi; Jeong, Seung Hoo; Singh, Ovender; Singh, Neetu; Park, Hyoung-Ryun; Lee, Junseong Multinuclear nickel(II) complexes with chiral schiff base ligand Inorganica Chimica Acta, 2020, 511, 119798 |
1564485 | CIF | C40 H102 Cl5.01 F0 Mo6 N19 O38.04 Ti | R 3 :H | 21.4608; 21.4608; 14.8972 90; 90; 120 | 5941.9 | Sugiarto,; Kazakami, Shota; Kawamoto, Keisuke; Hayashi, Yoshihito Stabilization of titanium(IV) and indium(III) complexes by coordination of [MoO3(1,4,7-triazacyclononane)] metalloligand in aqueous solution Inorganica Chimica Acta, 2020, 509, 119691 |
1564486 | CIF | C36 H90 Cl6 In2 Mo6 N18 O45 | R 3 :H | 22.041; 22.041; 14.5043 90; 90; 120 | 6102.2 | Sugiarto,; Kazakami, Shota; Kawamoto, Keisuke; Hayashi, Yoshihito Stabilization of titanium(IV) and indium(III) complexes by coordination of [MoO3(1,4,7-triazacyclononane)] metalloligand in aqueous solution Inorganica Chimica Acta, 2020, 509, 119691 |
1565779 | CIF | C81 H186 Ag20 O27 P12 Pt S24 | R 3 :H | 22.7267; 22.7267; 27.59 90; 90; 120 | 12341.1 | Gam, Franck; Chantrenne, Isaac; Kahlal, Samia; Chiu, Tzu-Hao; Liao, Jian-Hong; Liu, C. W.; Saillard, Jean-Yves Alloying dichalcogenolate-protected Ag<sub>21</sub> eight-electron nanoclusters: a DFT investigation. Nanoscale, 2021, 14, 196-203 |
1566522 | CIF | C69 H96 N6 O6 | R 3 :H | 20.366; 20.366; 13.791 90; 90; 120 | 4953.79 | Ding, Yanjun; Alimi, Lukman O.; Du, Jing; Hua, Bin; Dey, Avishek; Yu, Pei; Khashab, Niveen M. Pillar[3]trianglamines: deeper cavity triangular macrocycles for selective hexene isomer separation Chemical Science, 2022 |
1566523 | CIF | C66 H90 N6 O6 | R 3 :H | 20.3338; 20.3338; 13.7372 90; 90; 120 | 4918.88 | Ding, Yanjun; Alimi, Lukman O.; Du, Jing; Hua, Bin; Dey, Avishek; Yu, Pei; Khashab, Niveen M. Pillar[3]trianglamines: deeper cavity triangular macrocycles for selective hexene isomer separation Chemical Science, 2022 |
1568165 | CIF | C256 H432 Fe4 N28 O186 S12 | R 3 :H | 22.1273; 22.1273; 62.674 90; 90; 120 | 26575 | Schwab, Jake H.; Bailey, Jake B.; Gembicky, Milan; Stauber, Julia M. Programmable synthesis of well-defined, glycosylated iron(ii) supramolecular assemblies with multivalent protein-binding capabilities. Chemical science, 2023, 14, 1018-1026 |
1568353 | CIF | C15 H13 N3 Sn | R 3 :H | 28.972; 28.972; 8.1427 90; 90; 120 | 5919.1 | Sikora, Philipp; Naumann, Robert; Förster, Christoph; Heinze, Katja Excited state energy landscape of phosphorescent group 14 complexes. Chemical science, 2023, 14, 2489-2500 |
1569505 | CIF | C43.67 H35.67 Cl5 N8 O6 S2 | R 3 :H | 21.6918; 21.6918; 24.6601 90; 90; 120 | 10048.9 | Guo, Shen-Yi; Zhang, Zhuo-Ang; Tong, Shuo; Guo, Qing-Hui; Hua, Ruimao; Wang, Mei-Xiang Tetrahomo corona[4]arene-based spirophanes: synthesis, structure, and properties. Chemical science, 2023, 14, 8393-8400 |
1570702 | CIF | C34 H19 B | R 3 :H | 34.63; 34.63; 4.803 90; 90; 120 | 4988.2 | Schnitzlein, Matthias; Shoyama, Kazutaka; Würthner, Frank A highly fluorescent bora[6]helicene exhibiting circularly polarized light emission. Chemical science, 2024, 15, 2984-2989 |
2000380 | CIF Paper | C26 H26 O | R 3 :H | 23.978; 23.978; 8.918 90; 90; 120 | 4440.4 | Jones, P. G.; Schomburg, D.; Hopf, H.; Lehne, V. Structures of three derivatives of 5,12-methano[2.2.2]paracyclophane Acta Crystallographica Section C, 1992, 48, 2203-2207 |
2001597 | CIF Paper | C36 H30 Ir N3 | R 3 :H | 15.0144; 15.0144; 25.829 90; 90; 120 | 5042.6 | 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, 1993, 49, 1117-1120 |
2002320 | CIF | Ba3 Lu4 O9 | R 3 :H | 6.03; 6.03; 24.75299 90; 90; 120 | 779.5 | Krueger, J; Mueller-Buschbaum, Hk Ba3 Lu4 O9: Synthese und Strukturuntersuchung Zeitschrift fuer Anorganische und Allgemeine Chemie, 1984, 512, 59-64 |
2002333 | CIF | Ba3 O9 Yb4 | R 3 :H | 6.042; 6.042; 24.85899 90; 90; 120 | 785.9 | Krueger, J; Mueller-Buschbaum, Hk Die Struktur von Ba3 Yb4 O9 Revue de Chimie Minerale, 1983, 20, 456-461 |
2002469 | CIF | Ba3 O9 Tm4 | R 3 :H | 6.0556; 6.0556; 24.9572 90; 90; 120 | 792.6 | Mueller-Buschbaum, Hk; Scheikowski, M Zur Kristallstruktur von Ba3 Ln4 O9 (Ln = Tm, Ho) Zeitschrift fuer Anorganische und Allgemeine Chemie, 1990, 591, 181-187 |
2002470 | CIF | Ba3 Ho4 O9 | R 3 :H | 6.0975; 6.0975; 25.13559 90; 90; 120 | 809.3 | Mueller-Buschbaum, Hk; Scheikowski, M Zur Kristallstruktur von Ba3 Ln4 O9 (Ln = Tm, Ho) Zeitschrift fuer Anorganische und Allgemeine Chemie, 1990, 591, 181-187 |
2002599 | CIF | Ba3 Dy4 O9 | R 3 :H | 6.129; 6.129; 25.282 90; 90; 120 | 822.5 | Mueller-Buschbaum, Hk; Schrandt, O Zur Kristallstruktur von Ba3 Ln4 O9 (Ln=Dy, Er, Y/Yb) Journal of Alloys Compd., 1993, 191, 151-154 |
2002600 | CIF | Ba3 Er4 O9 | R 3 :H | 6.086; 6.086; 25.077 90; 90; 120 | 804.4 | Mueller-Buschbaum, Hk; Schrandt, O Zur Kristallstruktur von Ba3 Ln4 O9 (Ln=Dy, Er, Y/Yb) Journal of Alloys Compd., 1993, 191, 151-154 |
2002601 | CIF | Ba3 O9 Y2 Yb2 | R 3 :H | 6.077; 6.077; 25.01399 90; 90; 120 | 800 | Mueller-Buschbaum, Hk; Schrandt, O Zur Kristallstruktur von Ba3 Ln4 O9 (Ln=Dy, Er, Y/Yb) Journal of Alloys Compd., 1993, 191, 151-154 |
2004036 | CIF Paper | C48 H52 Cu4 N4 O8 | R 3 :H | 30.195; 30.195; 14.871 90; 90; 120 | 11742 | Fun, H.-K.; Yip, B.-C.; Song, B.-L.; Xiong, R.-G.; You, X.-Z. Tetrameric Copper(II) Complex of 6-Hydroxy-3-methyl-1-phenyl-4-azahexa-3-en-1-one Acta Crystallographica Section C, 1995, 51, 1980-1982 |
2004164 | CIF Paper | C57 H45 Fe N3 O3 P3 S3 | R 3 :H | 38.4; 38.4; 12.092 90; 90; 120 | 15442 | Olejnik, Z.; Lis, T.; Ondrejkovicová, I. <i>fac</i>-Tris(isothiocyanato)tris(triphenylphosphine oxide)iron(III) at 80 K Acta Crystallographica Section C, 1995, 51, 2246-2249 |
2005099 | CIF Paper | Li O4 P Zn | R 3 :H | 13.628; 13.628; 9.096 90; 90; 120 | 1463 | Bu, X.; Gier, T. E.; Stucky, G. D. A New Form of Lithium Zinc Phosphate with an Ordered Phenakite Structure, LiZnPO~4~ Acta Crystallographica Section C, 1996, 52, 1601-1603 |
2005767 | CIF Paper | C21 H21 Cl O3 Sn | R 3 :H | 16.094; 16.094; 6.717 90; 90; 120 | 1506.7 | Wharf, I.; Lebuis, A.-M. Chlorotris(<i>m</i>-methoxyphenyl)tin(IV) Acta Crystallographica Section C, 1996, 52, 3025-3027 |
2005897 | CIF Paper | C21 H21 Cl Sn | R 3 :H | 16.942; 16.942; 5.9187 90; 90; 120 | 1471.25 | Ng, S. W. Tribenzyltin Chloride Acta Crystallographica Section C, 1997, 53, 56-58 |
2006992 | CIF Paper | C8 H12 Cl N O4 S | R 3 :H | 21.511; 21.511; 6.369 90; 90; 120 | 2552 | Andres E. Goeta; Carlos E. Boschetti; Oreste Mascaretti; Graciela Punte 6α-Chloro-3α-hydroxymethyl-2,2-dimethylpenam 1,1-Dioxide Acta Crystallographica Section C, 1998, 54, 242-244 |
2007645 | CIF Paper | C24 H33 N O3 | R 3 :H | 27.132; 27.132; 8.29 90; 90; 120 | 5285 | Camalli, Mercedes; Pifferi, Augusto; Palmieri, Gianni Enantiopure δ-Hydroxy-β-enamino Ketones Acta Crystallographica Section C, 1998, 54, 1306-1309 |
2008217 | CIF Paper | C40 H66 B F4 N4 O9 P3 | R 3 :H | 18.1459; 18.1459; 12.2532 90; 90; 120 | 3494.1 | Foces-Foces, C.; Llamas-Saiz, A.L.; Alajarín, M.; López-Lázaro, A.; Molina, P.; N-Methyl-N,N,N-tris[2-(triethoxyphosphoranylideneamino)benzyl] ammonium Two <i>C</i>~3~-symmetrical tris(<i>ortho</i>-substituted) tribenzylamines Acta Crystallographica Section C, 1999, 55, 373-377 |
2009397 | CIF Paper | C10 H14 Cl O2 | R 3 :H | 22.426; 22.426; 6.395 90; 90; 120 | 2785 | Leigh, D. A.; Moody, A. E.; Pritchard, R. G. 2,7-Dimethyl-3,5-octadiyne-2,7-diol dichloromethane solvate: a clathrate comprising hydrogen-bonded supramolecular tunnels containing dichloromethane guest molecules Acta Crystallographica Section C, 1994, 50, 129-131 |
2010760 | CIF HKL Paper | C21 H21 O P | R 3 :H | 16.685; 16.685; 5.468 90; 90; 120 | 1318.3 | Novoa de Armas, Héctor; Pérez, Hiram; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J.; López, José Manuel Tribenzylphosphine oxide Acta Crystallographica Section C, 2000, 56, e98-e99 |
2011227 | CIF HKL Paper | C10 H15 N3 O4 | R 3 :H | 16.611; 16.611; 10.6471 90; 90; 120 | 2544.2 | Seela, Frank; He, Yang; Reuter, Hans; Heithoff, Eva-Maria 2'-Deoxy-5-methylisocytidine Acta Crystallographica Section C, 2000, 56, 989-991 |
2013852 | CIF HKL Paper | C30 H39 Cl O4 | R 3 :H | 34.3749; 34.3749; 5.7585 90; 90; 120 | 5892.8 | Thamotharan, S.; Parthasarathi, V.; Gupta, Ranju; Guleria, Sheetal; Jindal, D. P.; Linden, Anthony Two androst-5-ene derivatives: 16-[4-(3-chloropropoxy)-3-methoxybenzylidene]-17-oxoandrost-5-en-3β-ol and 16-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)benzylidene]-3β-pyrrolidinoandrost-5-en-17β-ol monohydrate Acta Crystallographica Section C, 2004, 60, o75-o78 |
2015441 | CIF HKL Paper | C11 H15 N O2 | R 3 :H | 23.561; 23.561; 5.7823 90; 90; 120 | 2779.8 | Yüce, Süheyla; Albayrak, Çiǧdem; Odabas̨oǧlu, Mustafa; Büyükgüngör, Orhan (<i>Z</i>)-6-{[1,3-Dihydroxy-2-(hydroxymethyl)propan-2-yliminio]methyl}-2-ethoxyphenolate, (<i>Z</i>)-6-{[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yliminio]methyl}-4-nitratocyclohexa-2,4-dienone monohydrate and (<i>R</i>,<i>E</i>)-2-[(1-hydroxybutan-2-ylimino)methyl]phenol Acta Crystallographica Section C, 2006, 62, o389-o393 |
2017128 | CIF HKL Paper | C15 H30 Cl6 Cu4 N10 O | R 3 :H | 17.548; 17.548; 7.898 90; 90; 120 | 2106.2 | Chiarella, Gina M.; Melgarejo, Doris Y.; Fackler Jr, John P. The neutral cluster amminehexa-μ~2~-chlorido-μ~4~-oxido-tris(1,4,6-triazabicyclo[3.3.0]oct-4-ene)tetracopper(II) Acta Crystallographica Section C, 2009, 65, m228-m230 |
2017293 | CIF HKL Paper | Cl3 H14 Li Mg O7 | R 3 :H | 9.2322; 9.2322; 12.0541 90; 90; 120 | 889.77 | Schmidt, Horst; Euler, Bernhard; Voigt, Wolfgang; Heide, Gerhard Lithium carnallite, LiCl·MgCl~2~·7H~2~O Acta Crystallographica Section C, 2009, 65, i57-i59 |
2019018 | CIF HKL Paper | C42 H44 Cl2 P2 | R 3 :H | 13.941; 13.941; 15.693 90; 90; 120 | 2641.3 | Levason, William; Pugh, David; Reid, Gillian Tribenzylphosphane and its hydrochloride salt, tribenzylphosphonium hydrogen dichloride‒tribenzylphosphane (1/1) Acta Crystallographica Section C, 2013, 69, 560-564 |
2023033 | CIF Paper | C29 H40 N4 O8.961 | R 3 :H | 24.3443; 24.3443; 14.55212 90; 90; 120 | 7468.81 | Kaduk, James A.; Boaz, Nicholas C.; Gates-Rector, Stacy; Gindhart, Amy M.; Blanton, Thomas N. Omadacycline dihydrate, C<sub>29</sub>H<sub>40</sub>N<sub>4</sub>O<sub>7</sub>·2H<sub>2</sub>O, from X-ray powder diffraction data. Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 292-295 |
2100853 | CIF Paper | Cl11 N3 P4 | R 3 :H | 10.6; 10.6; 14.167 90; 90; 120 | 1378.5 | Belaj, F. Structures and electron density distributions of [Cl-P(NPCl~3~)~3~]^+^.Cl^{-^} and [Cl-P(NPCl~3~)~3~]^+^.PCl~6~^{-^}.1/2C~2~H~2~Cl~4~ at 100 K Acta Crystallographica Section B, 1992, 48, 598-604 |
2101404 | CIF Paper | Cd P S3 | R 3 :H | 6.224; 6.224; 19.49 90; 90; 120 | 654 | Boucher, F.; Evain, M.; Brec, R. Phase transition upon <i>d</i>^10^ Cd^2+^ ordering in CdPS~3~ Acta Crystallographica Section B, 1995, 51, 952-961 |
2103124 | CIF Paper | C50 H121 Al3 F10 Li4 O5 Si9 | R 3 :H | 14.899; 14.899; 30.472 90; 90; 120 | 5857.9 | Herbst-Irmer, Regine; Sheldrick, George M. Refinement of obverse/reverse twins Acta Crystallographica, Section B: Structural Science, 2002, 58, 477-481 |
2105409 | CIF | B3 Cl6 N3 | R 3 :H | 8.847; 8.847; 10.321 90; 90; 120 | 699.591 | Groeneveld, W.L.; Verschoor, G.C.; Haasnoot, J.G.; Romers, C. On the crystal and molecular structure of hexachloroborazine Acta Crystallographica B (24,1968-38,1982), 1972, 28, 2070-2073 |
2106456 | CIF | H12 N3 O12 Sc Se3 | R 3 :H | 15.567; 15.567; 9.871 90; 90; 120 | 2071.58 | Valkonen, J.; Niinisto, L. Triammonium scandium selenate Acta Crystallographica B (24,1968-38,1982), 1978, 34, 266-268 |
2107150 | CIF | Li5.04 O17.92 Ta6.16 | R 3 :H | 5.1576; 5.1576; 13.7842 90; 90; 120 | 317.547 | Santoro, A.; Roth, R.S.; Austin, M. Powder neutron diffraction study of the nonstoichiometric solid solution of lithium tantalate (Li Ta O3)9 (Ta2 O5) Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1094-1098 |
2201632 | CIF HKL Paper | C12 H30 N2 O7 | R 3 :H | 12.065; 12.065; 9.633 90; 90; 120 | 1214.4 | Kemmitt, Tim; Gainsford, Graeme J.; Steel, Peter J.; Wikaira, Jan Four-centre hydrogen bonds: a triethanolamine‒triethanolamine oxide complex Acta Crystallographica Section E, 2002, 58, o851-o852 |
2204397 | CIF HKL Paper | C12 H24 Cl2 N6 S3 Zn | R 3 :H | 11.0498; 11.0498; 16.0416 90; 90; 120 | 1696.24 | Hai Qing Sun; Wen Tao Yu; Duo Rong Yuan; Xin Qing Wang; Gang, Xue Tris(allylthiourea-κ<i>S</i>)chlorozinc(II) chloride Acta Crystallographica Section E, 2004, 60, m1431-m1433 |
2207374 | CIF HKL Paper | Cs4 Se9 Sn3 Sr | R 3 :H | 14.528; 14.528; 9.685 90; 90; 120 | 1770.3 | Tobias van Almsick; William S. Sheldrick Tetracaesium strontium <i>catena</i>-nonaselenidotristannate(IV) Acta Crystallographica Section E, 2005, 61, i225-i227 |
2208270 | CIF HKL Paper | C24.67 H33.67 F O6.67 | R 3 :H | 17.857; 17.857; 18.0528 90; 90; 120 | 4985.3 | Jeß, Inke; Näther, Christian Triamcinolone acetonide methanol 0.67-solvate at 170 K Acta Crystallographica Section E, 2006, 62, o960-o962 |
2211031 | CIF HKL Paper | Ni3 O6 Te | R 3 :H | 5.1087; 5.1087; 13.767 90; 90; 120 | 311.17 | Becker, Richard; Berger, Helmuth Reinvestigation of Ni~3~TeO~6~ Acta Crystallographica Section E, 2006, 62, i222-i223 |
2211439 | CIF HKL Paper | C16 H14 Cl2 O3 | R 3 :H | 19.849; 19.849; 10.34 90; 90; 120 | 3528 | Zhen, Xiao-Li; Han, Jian-Rong; Wang, Qun-Tao; Tian, Xia; Liu, Shou-Xin 4-(2,4-Dichlorobenzyloxy)-3-ethoxybenzaldehyde Acta Crystallographica Section E, 2006, 62, o5794-o5795 |
2213999 | CIF HKL Paper | C31 H34 O8 | R 3 :H | 24.001; 24.001; 13.441 90; 90; 120 | 6705.3 | Zi-Jie Liu; Dong Han; Lin-Na Wang; Xiang-Bao Meng; Zhong-Jun Li 1,5-Di-<i>O</i>-acetyl-2,3,4-tri-<i>O</i>-benzyl-α-<small>D</small>-mannopyranoside Acta Crystallographica Section E, 2007, 63, o2975-o2975 |
2215550 | CIF HKL Paper | C12 H24 N3 O12 Tb | R 3 :H | 16.54; 16.54; 5.9554 90; 90; 120 | 1411 | Kameshwar, Prashant M.; Wadawale, Amey; Ajgaonkar, Vishnu R. Tris(<i>N</i>-acetylglycinato-κ^2^<i>O</i>,<i>O</i>')triaquaterbium(III) Acta Crystallographica Section E, 2007, 63, m2584-m2584 |
2215551 | CIF HKL Paper | C12 H24 N3 O12 Sm | R 3 :H | 16.58; 16.58; 5.978 90; 90; 120 | 1423.2 | Kameshwar, Prashant M.; Wadawale, Amey; Ajgaonkar, Vishnu R. Tris(<i>N</i>-acetylglycinato-κ^2^<i>O</i>,<i>O</i>')triaquasamarium(III) Acta Crystallographica Section E, 2007, 63, m2598-m2598 |
2218160 | CIF HKL Paper | C108 H76 Fe4 N18 O42 W12 | R 3 :H | 25.088; 25.088; 17.231 90; 90; 120 | 9392 | Ma, Feng-Xia; Chen, Ya-Guang; Shi, Dong-Mei Tris[tris(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')iron(II)] dodecatungstoferrate dihydrate Acta Crystallographica Section E, 2008, 64, m672 |
2220799 | CIF HKL Paper | C21 H21 Cl Sn | R 3 :H | 16.7985; 16.7985; 11.6875 90; 90; 120 | 2856.23 | Ng, Seik Weng Low-temperature redetermination of tribenzylchloridotin(IV) Acta Crystallographica Section E, 2009, 65, m238 |
2222312 | CIF HKL Paper | C45 H34 B Br N6 Ni | R 3 :H | 12.8227; 12.8227; 19.327 90; 90; 120 | 2752 | Harding, David J.; Harding, Phimphaka; Adams, Harry [Tris(3,5-diphenylpyrazolyl)hydroborato]nickel(II) bromide Acta Crystallographica Section E, 2009, 65, m773 |
2225315 | CIF HKL Paper | C13 H21 N3 O6 | R 3 :H | 16.8793; 16.8793; 15.1043 90; 90; 120 | 3726.83 | Jenkinson, Sarah F.; Lenagh-Snow, Gabriel M. J.; Izumori, Ken; Fleet, George W. J.; Watkin, David J.; Thompson, Amber L. 2-Azido-3,4;6,7-di-<i>O</i>-isopropylidene-α-<small>D</small>-<i>glycero</i>-<small>D</small>-<i>talo</i>-heptopyranose Acta Crystallographica Section E, 2010, 66, o525-o526 |
2227936 | CIF HKL Paper | C21 H15 Bi O6 | R 3 :H | 19.5608; 19.5608; 4.0967 90; 90; 120 | 1357.5 | Tumanov, Nikolay A.; Timakova, Evgenia V.; Boldyreva, Elena V. Tribenzoatobismuth(III): a new polymorph Acta Crystallographica Section E, 2010, 66, m1248 |
2229317 | CIF HKL Paper | C18 H25.67 N O5.33 | R 3 :H | 27.95; 27.95; 5.8035 90; 90; 120 | 3926.3 | Chakka, Sai Kumar; McKay, Michael G.; Govender, Thavendran; Kruger, Hendrik G.; Maguire, Glenn E. M. [(1<i>R</i>,3<i>S</i>)-6,7-Dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-3-yl]methanol 2.33-hydrate Acta Crystallographica Section E, 2011, 67, o700 |
2229407 | CIF HKL Paper | C18 H12 Br5 Fe2 N6 S6 | R 3 :H | 12.0638; 12.0638; 17.6907 90; 90; 120 | 2229.7 | Abedi, Anita; Amani, Vahid; Safari, Nasser Tris(4,4'-bi-1,3-thiazole-κ^2^<i>N</i>,<i>N</i>')iron(II) tetrabromidoferrate(III) bromide Acta Crystallographica Section E, 2011, 67, m311-m312 |
2230124 | CIF HKL Paper | C12 H24 Br2 N6 S3 Zn | R 3 :H | 11.3591; 11.3591; 14.5172 90; 90; 120 | 1622.19 | Sun, Hai-Qing; Wang, Xin-Qiang; Jin, Tao Tris(allylthiourea-κ<i>S</i>)bromidozinc(II) bromide Acta Crystallographica Section E, 2011, 67, m543 |
2232871 | CIF HKL Paper | C55 H59 O7 S9 Tb | R 3 :H | 13.9131; 13.9131; 24.6789 90; 90; 120 | 4137.2 | Veith, Michael; Belot, Celine; Huch, Volker Tris(tetrahydrofuran-κ<i>O</i>)tris[tris(thiophen-2-yl)methanolato-κ<i>O</i>]terbium(III) tetrahydrofuran monosolvate Acta Crystallographica Section E, 2011, 67, m1712 |
2236919 | CIF Paper | C57 H45 N3 O3 P3 S3 Tb | R 3 :H | 38.6774; 38.6774; 12.3956 90; 90; 120 | 16058.8 | Pham, Lam N.; Thames, Anthony T.; White, Frankie D.; Xiang, Kang Rui; Sykora, Richard E. Tris(thiocyanato-κ<i>N</i>)tris(triphenylphosphine oxide-κ<i>O</i>)terbium(III) Acta Crystallographica Section E, 2012, 68, m1531 |
2240921 | CIF | Cs4 Se9 Sn3 Sr | R 3 :H | 9.685; 9.685; 9.685 90; 90; 120 | 786.737 | Van Almsick, T.; Sheldrick, W. S. Tetracesium strontium catena-nona-selenidotristannate(IV) Acta Crystallographica Section E, 2005, 61, i225-i227 |
2241111 | CIF HKL Paper | C36 H77 Ce2 N15 Ni6 O37 | R 3 :H | 14.6418; 14.6418; 31.7767 90; 90; 120 | 5899.7 | Bezzubov, Stanislav I.; Doljenko, Vladimir D.; Churakov, Andrei V.; Zharinova, Irina S.; Kiselev, Yuri M. Crystal structure of an unknown solvate of dodecakis(μ~2~-alaninato-1:2κ^2^<i>O</i>:<i>N</i>,<i>O</i>)cerium(III)hexanickel(II) aquatris(hydroxido-κ<i>O</i>)tris(nitrato-κ^2^<i>O</i>,<i>O</i>')cerate(III) Acta Crystallographica Section E, 2015, 71, m183-m184 |
2310679 | CIF | Fe4 H5 O9 Si | R 3 :H | 5.49; 5.49; 42.5 90; 90; 120 | 1109.34 | Steadman, R.; Nuttall, P.M. Polymorphism in cronstedtite Acta Crystallographica (1,1948-23,1967), 1963, 16, 1-8 |
2311998 | CIF Paper | C63 H63 Eu O27 | R 3 :H | 27.194; 27.194; 7.6221 90; 90; 120 | 4881.5 | Han, Mei Rong; Li, Shao Dong; Ma, Ling; Yao, Bang; Feng, Si Si; Zhu, Miao Li Luminescent and magnetic bifunctional coordination complex based on a chiral tartaric acid derivative and europium. Acta crystallographica. Section C, Structural chemistry, 2019, 75, 1220-1227 |
4000730 | CIF | C90 H60 Ag6 F18 N24 O24 S6 | R 3 :H | 30.319; 30.319; 10.119 90; 90; 120 | 8055.6 | Xiao, Ze-Yun; Zhao, Xin; Jiang, Xi-Kui; Li, Zhan-Ting Tunable Coordinative Assembly of a Disc-Like Molecule and Metal Ions: From Mirospheres to Microtubes and Microrods Chemistry of Materials, 2011, 23, 1505 |
4001680 | CIF | Cd4 Cs Ga5 S12 | R 3 :H | 13.8639; 13.8639; 9.3974 90; 90; 120 | 1564.26 | Lin, Hua; Zhou, Liu-Jiang; Chen, Ling Sulfides with Strong Nonlinear Optical Activity and Thermochromism: ACd4Ga5S12(A = K, Rb, Cs) Chemistry of Materials, 2012, 24, 3406 |
4001681 | CIF | Cd4 Ga5 Rb S12 | R 3 :H | 13.8071; 13.8071; 9.3492 90; 90; 120 | 1543.51 | Lin, Hua; Zhou, Liu-Jiang; Chen, Ling Sulfides with Strong Nonlinear Optical Activity and Thermochromism: ACd4Ga5S12(A = K, Rb, Cs) Chemistry of Materials, 2012, 24, 3406 |
4001682 | CIF | Cd4 Ga5 K S12 | R 3 :H | 13.7905; 13.7905; 9.3304 90; 90; 120 | 1536.71 | Lin, Hua; Zhou, Liu-Jiang; Chen, Ling Sulfides with Strong Nonlinear Optical Activity and Thermochromism: ACd4Ga5S12(A = K, Rb, Cs) Chemistry of Materials, 2012, 24, 3406 |
4001994 | CIF | C96 H118 Cl5 Cu3 N25 O43 P6 | R 3 :H | 20.399; 20.399; 24.969 90; 90; 120 | 8998.1 | Srivastava, Anant Kumar; Praveenkumar, B.; Mahawar, Indra Kumar; Divya, Pillutla; Shalini, S.; Boomishankar, Ramamoorthy Anion Driven [CuIIL2]nFrameworks: Crystal Structures, Guest-Encapsulation, Dielectric, and Possible Ferroelectric Properties Chemistry of Materials, 2014, 26, 3811 |
4001997 | CIF | C65 H78 Cl4 Cu2 N16 O28 P4 | R 3 :H | 20.565; 20.565; 50.106 90; 90; 120 | 18352 | Srivastava, Anant Kumar; Praveenkumar, B.; Mahawar, Indra Kumar; Divya, Pillutla; Shalini, S.; Boomishankar, Ramamoorthy Anion Driven [CuIIL2]nFrameworks: Crystal Structures, Guest-Encapsulation, Dielectric, and Possible Ferroelectric Properties Chemistry of Materials, 2014, 26, 3811 |
4002256 | CIF | Li0.275 Ni0.725 O | R 3 :H | 6.02; 6.02; 14.726 90; 90; 120 | 462.177 | Monge, M.A.; Gutierrez-Puebla, E.; Martinez, J.L.; Campa, J.A.; Rasines, I. Cation distribution in lithium nickel oxide crystals Chemistry of Materials (1,1989-), 2000, 12, 2001-2007 |
4002706 | CIF | Cs Ga Se6 Sn2 | R 3 :H | 10.518; 10.518; 9.5385 90; 90; 120 | 913.85 | Lin, Hua; Chen, Ling; Yu, Ju-Song; Chen, Hong; Wu, Li-Ming Infrared SHG Materials CsM3Se6 (M = Ga/Sn, In/Sn): Phase Matchability Controlled by Dipole Moment of the Asymmetric Building Unit Chemistry of Materials, 2017, 29, 499 |
4002707 | CIF | Cs In Se6 Sn2 | R 3 :H | 10.652; 10.652; 9.6882 90; 90; 120 | 952 | Lin, Hua; Chen, Ling; Yu, Ju-Song; Chen, Hong; Wu, Li-Ming Infrared SHG Materials CsM3Se6 (M = Ga/Sn, In/Sn): Phase Matchability Controlled by Dipole Moment of the Asymmetric Building Unit Chemistry of Materials, 2017, 29, 499 |
4002826 | CIF | Ba6 Ga2 S16 Zn7 | R 3 :H | 9.7723; 9.7723; 27.006 90; 90; 120 | 2233.5 | Li, Yan-Yan; Liu, Peng-Fei; Wu, Li-Ming Ba6Zn7Ga2S16: A Wide Band Gap Sulfide with Phase-Matchable Infrared NLO Properties Chemistry of Materials, 2017, 29, 5259 |
4002844 | CIF | Ga5 Hg4 K Se12 | R 3 :H | 14.3203; 14.3203; 9.7057 90; 90; 120 | 1723.7 | Zhou, Molin; Yang, Yi; Guo, Yangwu; Lin, Zheshuai; Yao, Jiyong; Wu, Yicheng; Chen, Chuangtian Hg-Based Infrared Nonlinear Optical Material KHg4Ga5Se12 Exhibits Good Phase-Matchability and Exceptional Second Harmonic Generation Response Chemistry of Materials, 2017, 29, 7993 |
4020076 | CIF | C73 H80 Cl2 N2 O P2 Ru | R 3 :H | 24.32; 24.32; 55.8 90; 90; 120 | 28606 | Helen L. Ngo; Wenbin Lin Journal of Organic Chemistry, 2005, 70, 1177-1187 |
4022248 | CIF | C17 H26 N O3 S | R 3 :H | 20.698; 20.698; 11.1777 90; 90; 120 | 4147.1 | Tony P. Tang; Jonathan A. Ellman Asymmetric Synthesis of β-Amino Acid Derivatives Incorporating a Broad Range of Substitution Patterns by Enolate Additions to tert-Butanesulfinyl Imines Journal of Organic Chemistry, 2002, 67, 7819-7832 |
4023258 | CIF | C36 H63 N15 O9 | R 3 :H | 18.518; 18.518; 13.44 90; 90; 120 | 3991.3 | Philippe Le Grel; Arnaud Salaün; Clémence Mocquet; Barbara Le Grel; Thierry Roisnel; Michel Potel Postsynthetic Modification of C~3~-Symmetric Aza-β^3^-Cyclohexapeptides Journal of Organic Chemistry, 2008, 73, 1306-1310 |
4023275 | CIF | C46 H51 Cl6 O6 S12 | R 3 :H | 21.2273; 21.2273; 11.3541 90; 90; 120 | 4430.7 | Yangping Liu; Frederick A. Villamena; Jian Sun; Yingkai Xu; Ilirian Dhimitruka; Jay L. Zweier Synthesis and Characterization of Ester-Derivatized Tetrathiatriarylmethyl Radicals as Intracellular Oxygen Probes Journal of Organic Chemistry, 2008, 73, 1490-1497 |
4024044 | CIF | C28 H30 O11 S | R 3 :H | 27.9054; 27.9054; 9.5055 90; 90; 120 | 6410.4 | Indrajit Das; Tarun K. Pal; Cheravakkattu G. Suresh; Tanmaya Pathak Diastereoselective C-C Bond Formation at C-5 of Vinyl Sulfone-Modified Hex-5-enofuranosyl Carbohydrates: Diversity-Oriented Synthesis of Branched-Chain Sugars and Beyond Journal of Organic Chemistry, 2007, 72, 5523-5533 |
4024616 | CIF | C31 H42 I N3 O5 | R 3 :H | 44.8052; 44.8052; 8.8254 90; 90; 120 | 15343.4 | Carlos Saavedra; Rosendo Hernández; Alicia Boto; Eleuterio Álvarez Catalytic, One-Pot Synthesis of β-Amino Acids from α-Amino Acids. Preparation of α,β-Peptide Derivatives Journal of Organic Chemistry, 2009, 74, 4655-4665 |
4026557 | CIF | C33 H39 N9 O9 | R 3 :H | 14.2352; 14.2352; 15.1711 90; 90; 120 | 2662.4 | Martin R. Krause; Richard Goddard; Stefan Kubik Anion-Binding Properties of a Cyclic Pseudohexapeptide Containing 1,5-Disubstituted 1,2,3-Triazole Subunits Journal of Organic Chemistry, 2011, 76, 7084-7095 |
4026863 | CIF | C41 H51.17 N5 O14.33 P2.5 | R 3 :H | 30.4865; 30.4865; 12.0383 90; 90; 120 | 9689.7 | Vicente Martí-Centelles; M. Isabel Burguete; Francisco Galindo; M. Angeles Izquierdo; D. Krishna Kumar; Andrew J.P. White; Santiago V. Luis; Ramón Vilar Fluorescent Acridine-Based Receptors for H2PO4- Journal of Organic Chemistry, 2012, 77, 490-500 |
4030119 | CIF | C15 H19 N O4 | R 3 :H | 25.9883; 25.9883; 5.81758 90; 90; 120 | 3402.74 | Csatayová, Kristína; Davies, Stephen G.; Fletcher, Ai M.; Ford, J. Gair; Klauber, David J.; Roberts, Paul M.; Thomson, James E. Asymmetric syntheses of (-)-3-epi-Fagomine, (2R,3S,4R)-dihydroxypipecolic acid, and several polyhydroxylated homopipecolic acids. The Journal of organic chemistry, 2014, 79, 10932-10944 |
4035592 | CIF | C109 H103 Cl3 O24 | R 3 :H | 30.9223; 30.9223; 8.3338 90; 90; 120 | 6901.08 | Su, Jun-Cheng; Wang, Shan; Cheng, Wen; Huang, Xiao-Jun; Li, Man-Mei; Jiang, Ren-Wang; Li, Yao-Lan; Wang, Lei; Ye, Wen-Cai; Wang, Ying Phloroglucinol Derivatives with Unusual Skeletons from Cleistocalyx operculatus and Their in Vitro Antiviral Activity. The Journal of organic chemistry, 2018, 83, 8522-8532 |
4037249 | CIF | C20 H23 N O2 Si | R 3 :H | 26.426; 26.426; 7.039 90; 90; 120 | 4257 | Huang, Jing-Kai; Wong, Ying-Chieh; Kao, Tzu-Ting; Tseng, Chen-Tso; Shia, Kak-Shan Cobalt(II)-Catalyzed Aerobic Oxidation of Terminal-Capped Alkynyl α-Cyano Alkanone Systems. An Oxygen-Mediated Radical Chain Reaction. The Journal of organic chemistry, 2016, 81, 10759-10768 |
4037469 | CIF | C19 H15 Br N2 O3 | R 3 :H | 20.8688; 20.8688; 12.2249 90; 90; 120 | 4610.7 | Yang, Peng; Wang, Xiao; Chen, Feng; Zhang, Zheng-Bing; Chen, Chao; Peng, Lin; Wang, Li-Xin Organocatalytic Enantioselective Michael/Cyclization Domino Reaction between 3-Amideoxindoles and α,β-Unsaturated Aldehydes: One-Pot Preparation of Chiral Spirocyclic Oxindole-γ-lactams. The Journal of organic chemistry, 2017, 82, 3908-3916 |
4037899 | CIF | C33 H33 Cl3 D I3 O3 | R 3 :H | 11.2613; 11.2613; 24.166 90; 90; 120 | 2654.07 | Wagner, Philippe; Rominger, Frank; Oeser, Thomas; Mastalerz, Michael Solvent Controlled Racemic Resolution of C3-Symmetric Trihydroxytribenzotriquinacenes. The Journal of organic chemistry, 2020 |
4037902 | CIF | C33 H34 Cl3 I3 O3 | R 3 :H | 11.2774; 11.2774; 24.1597 90; 90; 120 | 2661 | Wagner, Philippe; Rominger, Frank; Oeser, Thomas; Mastalerz, Michael Solvent Controlled Racemic Resolution of C3-Symmetric Trihydroxytribenzotriquinacenes. The Journal of organic chemistry, 2020 |
4065620 | CIF | C36 H75 Li3 N6 | R 3 :H | 19.546; 19.546; 8.9796 90; 90; 120 | 2971 | Gessner, Viktoria H.; Strohmann, Carsten Lithiation of Diamine Ligands to Chiral Building Blocks: Syntheses, Selectivities, and Lithiated Intermediates Organometallics, 2010, 29, 1858 |
4066268 | CIF | C18 H48 Ge4 Si | R 3 :H | 14.591; 14.591; 10.863 90; 90; 120 | 2002.9 | Hlina, Johann; Baumgartner, Judith; Marschner, Christoph Polygermane Building Blocks† Organometallics, 2010, 29, 5289 |
4066277 | CIF | C22 H57 Li4 N9 | R 3 :H | 21.3969; 21.3969; 12.3807 90; 90; 120 | 4908.8 | Kamps, Ina; Neumann, Beate; Stammler, Hans-Georg; Mitzel, Norbert W. A Chain Aggregate of Methyllithium Tetramers† Organometallics, 2010, 29, 4746 |
4070991 | CIF | C57 H129 Ca3 N3 O9 Si6 | R 3 :H | 17.8268; 17.8268; 20.7329 90; 90; 120 | 5706.07 | He, Xuyang; Hurley, Erin; Noll, Bruce C.; Henderson, Kenneth W. Regio- and Stereoselective Enolizations Using Calcium Bis(hexamethyldisilazide) as a Base: Synthetic, Solid-State, and Solution Studies Organometallics, 2008, 27, 3094 |
4071837 | CIF | C14 H16 B N7 O3 S3 W | R 3 :H | 14.2437; 14.2437; 17.8872 90; 90; 120 | 3142.81 | Abernethy, Robyn J.; Foreman, Mark R. St.-J.; Hill, Anthony F.; Tshabang, Never; Willis, Anthony C.; Young, Rowan D. Poly(methimazolyl)borato Nitrosyl Complexes of Molybdenum and Tungsten Organometallics, 2008, 27, 4455 |
4074872 | CIF | C50 H47 B Cl F4 N O P2 Pt Se | R 3 :H | 21.6188; 21.6188; 54.139 90; 90; 120 | 21913.1 | Yeo, Wee-Chuan; Vittal, Jagadese J.; Koh, Lip Lin; Tan, Geok Kheng; Leung, Pak-Hing Functionalization of Metal-Protected Chiral Phosphines via Simple Organic Transformations Organometallics, 2006, 25, 1259-1269 |
4076210 | CIF | C18 H48 Si4 Sn | R 3 :H | 14.617; 14.617; 11.024 90; 90; 120 | 2039.8 | Baumgartner, Judith; Fischer, Roland; Fischer, Jelena; Wallner, Andreas; Marschner, Christoph; Flörke, Ulrich Structural Aspects of Trimethylsilylated Branched Group 14 Compounds Organometallics, 2005, 24, 6450 |
4076212 | CIF | C18 H48 Ge Si4 | R 3 :H | 14.714; 14.714; 10.906 90; 90; 120 | 2044.8 | Baumgartner, Judith; Fischer, Roland; Fischer, Jelena; Wallner, Andreas; Marschner, Christoph; Flörke, Ulrich Structural Aspects of Trimethylsilylated Branched Group 14 Compounds Organometallics, 2005, 24, 6450 |
4076217 | CIF | C18 H48 Si4 Sn | R 3 :H | 14.663; 14.663; 10.99 90; 90; 120 | 2046.3 | Baumgartner, Judith; Fischer, Roland; Fischer, Jelena; Wallner, Andreas; Marschner, Christoph; Flörke, Ulrich Structural Aspects of Trimethylsilylated Branched Group 14 Compounds Organometallics, 2005, 24, 6450 |
4076218 | CIF | C18 H48 Ge Si3 Sn | R 3 :H | 14.701; 14.701; 11.021 90; 90; 120 | 2062.7 | Baumgartner, Judith; Fischer, Roland; Fischer, Jelena; Wallner, Andreas; Marschner, Christoph; Flörke, Ulrich Structural Aspects of Trimethylsilylated Branched Group 14 Compounds Organometallics, 2005, 24, 6450 |
4076219 | CIF | C18 H54 Ge Si6 Sn | R 3 :H | 16.257; 16.257; 11.58 90; 90; 120 | 2650.5 | Baumgartner, Judith; Fischer, Roland; Fischer, Jelena; Wallner, Andreas; Marschner, Christoph; Flörke, Ulrich Structural Aspects of Trimethylsilylated Branched Group 14 Compounds Organometallics, 2005, 24, 6450 |
4077020 | CIF | C8 H19 Cl Cu N2 O2 | R 3 :H | 20.776; 20.776; 13.728 90; 90; 120 | 5131.7 | Kozlowski, Marisa C.; Li, Xiaolin; Carroll, Patrick J.; Xu, Zhenrong Copper(II) Complexes of Novel 1,5-Diaza-cis-decalin Diamine Ligands: An Investigation of Structure and Reactivity Organometallics, 2002, 21, 4513 |
4079035 | CIF | C30 H50 Br11 Cu8 N3 O | R 3 :H | 12.125; 12.125; 29.3362 90; 90; 120 | 3735.1 | Ye, Qiong; Liu, Ming-Liang; Chen, Zi-Qi; Sun, Su-Wen; Xiong, Ren-Gen Solvothermal Syntheses and Physical Properties of Noncentrosymmetric Olefin‒Copper(I) Coordination Compounds Organometallics, 2012, 31, 7862 |
4079096 | CIF | C76 H60 N2 Ni O6 P2 | R 3 :H | 37.5195; 37.5195; 13.494 90; 90; 120 | 16450.7 | Linden, Anthony; Llovera, Ligia; Herrera, Julio; Dorta, Reto; Agrifoglio, Giuseppe; Dorta, Romano “Chiral-at-Metal” Hemilabile Nickel Complexes with a Latent d10-ML2Configuration: Receiving Substrates with Open Arms Organometallics, 2012, 31, 6162 |
4079561 | CIF | C26 H17 Fe2 N O5 S | R 3 :H | 39.0863; 39.0863; 8.5612 90; 90; 120 | 11327 | Hirotsu, Masakazu; Santo, Kiyokazu; Hashimoto, Hideki; Kinoshita, Isamu Carbon- and Sulfur-Bridged Diiron Carbonyl Complexes Containing N,C,S-Tridentate Ligands Derived from Functionalized Dibenzothiophenes: Mimics of the [FeFe]-Hydrogenase Active Site Organometallics, 2012, 31, 7548 |
4085634 | CIF | C29 H27 Cl F N3 O | R 3 :H | 32.2621; 32.2621; 12.7055 90; 90; 120 | 11452.7 | Espina, Manuela; Rivilla, Ivan; Conde, Ana; Díaz-Requejo, M. Mar; Pérez, Pedro J.; Álvarez, Eleuterio; Fernández, Rosario; Lassaletta, José M. Chiral, Sterically Demanding N-Heterocyclic Carbenes Fused into a Heterobiaryl Skeleton: Design, Synthesis, and Structural Analysis Organometallics, 2015, 150320082744001 |
4085638 | CIF | C38 H43 Ag Cl N3 | R 3 :H | 32.156; 32.156; 17.2446 90; 90; 120 | 15442 | Espina, Manuela; Rivilla, Ivan; Conde, Ana; Díaz-Requejo, M. Mar; Pérez, Pedro J.; Álvarez, Eleuterio; Fernández, Rosario; Lassaletta, José M. Chiral, Sterically Demanding N-Heterocyclic Carbenes Fused into a Heterobiaryl Skeleton: Design, Synthesis, and Structural Analysis Organometallics, 2015, 150320082744001 |
4085640 | CIF | C38 H43 Au Cl N3 | R 3 :H | 32.367; 32.367; 17.135 90; 90; 120 | 15546 | Espina, Manuela; Rivilla, Ivan; Conde, Ana; Díaz-Requejo, M. Mar; Pérez, Pedro J.; Álvarez, Eleuterio; Fernández, Rosario; Lassaletta, José M. Chiral, Sterically Demanding N-Heterocyclic Carbenes Fused into a Heterobiaryl Skeleton: Design, Synthesis, and Structural Analysis Organometallics, 2015, 150320082744001 |
4085938 | CIF | C34 H58 Fe N4 | R 3 :H | 27.826; 27.826; 13.4682 90; 90; 120 | 9031.1 | Wang, Xiaojie; Zhang, Jia; Wang, Lei; Deng, Liang High-Spin Iron(II) Alkynyl Complexes with N-Heterocyclic Carbene Ligation: Synthesis, Characterization, and Reactivity Study Organometallics, 2015, 34, 2775 |
4087862 | CIF | C60 H54 Au3 N3 O40 P4 W12 | R 3 :H | 19.364; 19.364; 19.277 90; 90; 120 | 6260 | Hueber, Damien; Hoffmann, Marie; de Frémont, Pierre; Pale, Patrick; Blanc, Aurélien Polyoxometalate-Gold(I)/H+ Complexes: Air-Stable, Efficient, Polyvalent, and Bifunctional Catalysts Organometallics, 2015, 34, 5065 |
4087863 | CIF | C60 H54 Au3 Mo12 N3 O40 P4 | R 3 :H | 19.2972; 19.2972; 19.2127 90; 90; 120 | 6195.9 | Hueber, Damien; Hoffmann, Marie; de Frémont, Pierre; Pale, Patrick; Blanc, Aurélien Polyoxometalate-Gold(I)/H+ Complexes: Air-Stable, Efficient, Polyvalent, and Bifunctional Catalysts Organometallics, 2015, 34, 5065 |
4088789 | CIF | C72 H90 Li12 N6 | R 3 :H | 25.7286; 25.7286; 8.9644 90; 90; 120 | 5139.07 | Flynn, Matthew T.; Stott, Rachel; Blair, Victoria L.; Andrews, Philip C. Loss of Chirality through Facile Lewis Base Mediated Aza-enolate Formation in Na and K (S)-N-(α-Methylbenzyl)methallylamides Organometallics, 2016, 35, 2707 |
4101687 | CIF | C36 H38 B F12 P | R 3 :H | 16.964; 16.964; 9.963 90; 90; 120 | 2483 | Ullrich, Matthias; Lough, Alan J.; Stephan, Douglas W. Reversible, metal-free, heterolytic activation of H2 at room temperature. Journal of the American Chemical Society, 2009, 131, 52-53 |
4102169 | CIF | C168 H222 Cl4 Mn25 N15 O112 | R 3 :H | 26.847; 26.847; 33.221 90; 90; 120 | 20736 | Cai-Ming Liu; Ren-Gen Xiong; De-Qing Zhang; Dao-Ben Zhu Nanoscale Homochiral C3-Symmetric Mixed-Valence Manganese Cluster Complexes with Both Ferromagnetic and Ferroelectric Properties Journal of the American Chemical Society, 2010, 132, 4044-4045 |
4102170 | CIF | C168 H222 Cl4 Mn25 N15 O112 | R 3 :H | 26.933; 26.933; 33.251 90; 90; 120 | 20888 | Cai-Ming Liu; Ren-Gen Xiong; De-Qing Zhang; Dao-Ben Zhu Nanoscale Homochiral C3-Symmetric Mixed-Valence Manganese Cluster Complexes with Both Ferromagnetic and Ferroelectric Properties Journal of the American Chemical Society, 2010, 132, 4044-4045 |
4103410 | CIF | C180 Cl6 Mn6 N12 O38 Zn8 | R 3 :H | 29.585; 29.585; 72.4624 90; 90; 120 | 54927.1 | Feijie Song; Cheng Wang; Joseph M. Falkowski; Liqing Ma; Wenbin Lin Isoreticular Chiral Metal-Organic Frameworks for Asymmetric Alkene Epoxidation: Tuning Catalytic Activity by Controlling Framework Catenation and Varying Open Channel Sizes Journal of the American Chemical Society, 2010, 132, 15390-15398 |
4103412 | CIF | C204 Cl6 Mn6 N12 O38 Zn8 | R 3 :H | 35.884; 35.884; 87.911 90; 90; 120 | 98034 | Feijie Song; Cheng Wang; Joseph M. Falkowski; Liqing Ma; Wenbin Lin Isoreticular Chiral Metal-Organic Frameworks for Asymmetric Alkene Epoxidation: Tuning Catalytic Activity by Controlling Framework Catenation and Varying Open Channel Sizes Journal of the American Chemical Society, 2010, 132, 15390-15398 |
4103413 | CIF | C252 Cl6 Mn6 N12 O38 Zn8 | R 3 :H | 41.9263; 41.9263; 100.286 90; 90; 120 | 152667 | Feijie Song; Cheng Wang; Joseph M. Falkowski; Liqing Ma; Wenbin Lin Isoreticular Chiral Metal-Organic Frameworks for Asymmetric Alkene Epoxidation: Tuning Catalytic Activity by Controlling Framework Catenation and Varying Open Channel Sizes Journal of the American Chemical Society, 2010, 132, 15390-15398 |
4104069 | CIF | C93 H81 O9 P | R 3 :H | 23.9458; 23.9458; 10.7465 90; 90; 120 | 5336.5 | Manfred T. Reetz; Hongchao Guo; Jun-An Ma; Richard Goddard; Richard J. Mynott Helical Triskelion Monophosphites as Ligands in Asymmetric Catalysis Journal of the American Chemical Society, 2009, 131, 4136-4142 |
4104070 | CIF | C93 H81 O9 P | R 3 :H | 23.8503; 23.8503; 10.7465 90; 90; 120 | 5294 | Manfred T. Reetz; Hongchao Guo; Jun-An Ma; Richard Goddard; Richard J. Mynott Helical Triskelion Monophosphites as Ligands in Asymmetric Catalysis Journal of the American Chemical Society, 2009, 131, 4136-4142 |
4105112 | CIF | C46 H67 N11 O6 | R 3 :H | 25.421; 25.421; 6.6885 90; 90; 120 | 3743.2 | Clémence Mocquet; Arnaud Salaün; Paul Claudon; Barbara Le Grel; Michel Potel; Gilles Guichard; Brigitte Jamart-Grégoire; Philippe Le Grel Aza-β3-cyclopeptides: A New Way of Controlling Nitrogen Chirality Journal of the American Chemical Society, 2009, 131, 14521-14525 |
4105593 | CIF | C81 H116 B6 F24 N18 O22 Pd3 | R 3 :H | 15.5209; 15.5209; 39.8268 90; 90; 120 | 8308.8 | Tae Hwan Noh; Eunjung Heo; Kang Hyun Park; Ok-Sang Jung Motion of an Isolated Water Molecule within a Flexible Coordination Cage: Structural Properties and Catalytic Effects of Ionic Palladium(II) Complexes Journal of the American Chemical Society, 2011, 133, 1236-1239 |
4105594 | CIF | C81 H116 Cl6 N18 O47 Pd3 | R 3 :H | 15.5257; 15.5257; 40.6727 90; 90; 120 | 8490.55 | Tae Hwan Noh; Eunjung Heo; Kang Hyun Park; Ok-Sang Jung Motion of an Isolated Water Molecule within a Flexible Coordination Cage: Structural Properties and Catalytic Effects of Ionic Palladium(II) Complexes Journal of the American Chemical Society, 2011, 133, 1236-1239 |
4105637 | CIF | C17 H14.67 F N O3.33 | R 3 :H | 25.205; 25.205; 5.987 90; 90; 120 | 3294 | Filippo Sladojevich; Andrea Trabocchi; Antonio Guarna; Darren J. Dixon A New Family of Cinchona-Derived Amino Phosphine Precatalysts: Application to the Highly Enantio- and Diastereoselective Silver-Catalyzed Isocyanoacetate Aldol Reaction Journal of the American Chemical Society, 2011, 133, 1710-1713 |
4105819 | CIF | C49 H78 Fe Na O4 P3 Si | R 3 :H | 17.9012; 17.9012; 13.0887 90; 90; 120 | 3632.4 | Yunho Lee; Jonas C. Peters Silylation of Iron-Bound Carbon Monoxide Affords a Terminal Fe Carbyne Journal of the American Chemical Society, 2011, 133, 4438-4446 |
4106951 | CIF | C120 H97 N12 O0.5 | R 3 :H | 29.29; 29.29; 21.799 90; 90; 120 | 16196 | Michael J. Bojdys; Michael E. Briggs; James T. A. Jones; Dave J. Adams; Samantha Y. Chong; Marc Schmidtmann; Andrew I. Cooper Supramolecular Engineering of Intrinsic and Extrinsic Porosity in Covalent Organic Cages Journal of the American Chemical Society, 2011, 133, 16566-16571 |
4106952 | CIF | C120 H96 N12 | R 3 :H | 29.494; 29.494; 11.036 90; 90; 120 | 8314 | Michael J. Bojdys; Michael E. Briggs; James T. A. Jones; Dave J. Adams; Samantha Y. Chong; Marc Schmidtmann; Andrew I. Cooper Supramolecular Engineering of Intrinsic and Extrinsic Porosity in Covalent Organic Cages Journal of the American Chemical Society, 2011, 133, 16566-16571 |
4106953 | CIF | C120 H96 N17 | R 3 :H | 29.175; 29.175; 10.882 90; 90; 120 | 8022 | Michael J. Bojdys; Michael E. Briggs; James T. A. Jones; Dave J. Adams; Samantha Y. Chong; Marc Schmidtmann; Andrew I. Cooper Supramolecular Engineering of Intrinsic and Extrinsic Porosity in Covalent Organic Cages Journal of the American Chemical Society, 2011, 133, 16566-16571 |
4106954 | CIF | C124.5 H89.5 Cl13.5 F12 N12 O0.5 | R 3 :H | 30.587; 30.587; 21.553 90; 90; 120 | 17463 | Michael J. Bojdys; Michael E. Briggs; James T. A. Jones; Dave J. Adams; Samantha Y. Chong; Marc Schmidtmann; Andrew I. Cooper Supramolecular Engineering of Intrinsic and Extrinsic Porosity in Covalent Organic Cages Journal of the American Chemical Society, 2011, 133, 16566-16571 |
4107036 | CIF | C20 H23 F3 O6 | R 3 :H | 26.422; 26.422; 7.967 90; 90; 120 | 4817 | Martin J. Schnermann; Christopher M. Beaudry; Nathan E. Genung; Stephen M. Canham; Nicholas L. Untiedt; Breanne D. W. Karanikolas; Christine Sütterlin; Larry E. Overman Divergent Synthesis and Chemical Reactivity of Bicyclic Lactone Fragments of Complex Rearranged Spongian Diterpenes Journal of the American Chemical Society, 2011, 133, 17494-17503 |
4107655 | CIF | C252 H300 N24 O18 Zn6 | R 3 :H | 44.861; 44.861; 10.203 90; 90; 120 | 17783 | Gao Li; Weibin Yu; Yong Cui A Homochiral Nanotubular Crystalline Framework of Metallomacrocycles for Enantioselective Recognition and Separation Journal of the American Chemical Society, 2008, 130, 4582-4583 |
4107656 | CIF | C258 H324 N24 O18 Zn6 | R 3 :H | 45.037; 45.037; 10.3862 90; 90; 120 | 18244.3 | Gao Li; Weibin Yu; Yong Cui A Homochiral Nanotubular Crystalline Framework of Metallomacrocycles for Enantioselective Recognition and Separation Journal of the American Chemical Society, 2008, 130, 4582-4583 |
4107784 | CIF | C15 H11 N O2 | R 3 :H | 19.435; 19.435; 8.189 90; 90; 120 | 2678.7 | Shui-Ming Lu; Howard Alper Sequence of Intramolecular Carbonylation and Asymmetric Hydrogenation Reactions: Highly Regio- and Enantioselective Synthesis of Medium Ring Tricyclic Lactams Journal of the American Chemical Society, 2008, 130, 6451-6455 |
4107786 | CIF | C15 H13 N O2 | R 3 :H | 19.8173; 19.8173; 8.1477 90; 90; 120 | 2771.1 | Shui-Ming Lu; Howard Alper Sequence of Intramolecular Carbonylation and Asymmetric Hydrogenation Reactions: Highly Regio- and Enantioselective Synthesis of Medium Ring Tricyclic Lactams Journal of the American Chemical Society, 2008, 130, 6451-6455 |
4109572 | CIF | C76 H62 Cu2 N10 O7 | R 3 :H | 27.7103; 27.7103; 24.1747 90; 90; 120 | 16075.9 | Jungseok Heo; You-Moon Jeon; Chad A. Mirkin Reversible Interconversion of Homochiral Triangular Macrocycles and Helical Coordination Polymers Journal of the American Chemical Society, 2007, 129, 7712-7713 |
4109573 | CIF | C76 H61.33 Cu2 N10 O6.67 | R 3 :H | 27.7575; 27.7575; 24.198 90; 90; 120 | 16146 | Jungseok Heo; You-Moon Jeon; Chad A. Mirkin Reversible Interconversion of Homochiral Triangular Macrocycles and Helical Coordination Polymers Journal of the American Chemical Society, 2007, 129, 7712-7713 |
4112861 | CIF | C38 H77 Li6 N6 O6 | R 3 :H | 16.746; 16.746; 15.221 90; 90; 120 | 3696.5 | Carsten Strohmann; Timo Seibel; Daniel Schildbach The Crystal Structures of a Chiral Aminoalkoxide Cluster and Its Adduct with Benzyllithium Journal of the American Chemical Society, 2004, 126, 9876-9877 |
4112997 | CIF | C69 H87 Cl6 N7 O12 S6 | R 3 :H | 16.3404; 16.3404; 28.0178 90; 90; 120 | 6478.7 | Christos A. Ilioudis; Derek A. Tocher; Jonathan W. Steed A Highly Efficient, Preorganized Macrobicyclic Receptor for Halides Based on CH... and NH...Anion Interactions Journal of the American Chemical Society, 2004, 126, 12395-12402 |
4113336 | CIF | C60 H81 Ir3 N6 O9 | R 3 :H | 18.832; 18.832; 13.812 90; 90; 120 | 4242 | Zacharias Grote; Rosario Scopelliti; Kay Severin pH-Triggered Assembly of Organometallic Receptors for Lithium Ions Journal of the American Chemical Society, 2004, 126, 16959-16972 |
4113530 | CIF | C66 H90 N18 O48 Pr4 | R 3 :H | 27.396; 27.3958; 10.7569 90; 90; 120 | 6991.8 | Tomoaki Hamada; Kei Manabe; Shunpei Ishikawa; Satoshi Nagayama; Motoo Shiro; Shū Kobayashi Catalytic Asymmetric Aldol Reactions in Aqueous Media Using Chiral Bis-pyridino-18-crown-6-Rare Earth Metal Triflate Complexes Journal of the American Chemical Society, 2003, 125, 2989-2996 |
4113534 | CIF | C22.67 H28 Br2 N6 O16.33 Pr1.33 | R 3 :H | 26.87; 26.8699; 11.6699 90; 90; 120 | 7296.8 | Tomoaki Hamada; Kei Manabe; Shunpei Ishikawa; Satoshi Nagayama; Motoo Shiro; Shū Kobayashi Catalytic Asymmetric Aldol Reactions in Aqueous Media Using Chiral Bis-pyridino-18-crown-6-Rare Earth Metal Triflate Complexes Journal of the American Chemical Society, 2003, 125, 2989-2996 |
4113554 | CIF | C22 H30 Ce1.33 N6 O16 | R 3 :H | 27.433; 27.439; 10.784 90; 90; 120 | 7030 | Tomoaki Hamada; Kei Manabe; Shunpei Ishikawa; Satoshi Nagayama; Motoo Shiro; Shū Kobayashi Catalytic Asymmetric Aldol Reactions in Aqueous Media Using Chiral Bis-pyridino-18-crown-6-Rare Earth Metal Triflate Complexes Journal of the American Chemical Society, 2003, 125, 2989-2996 |
4115086 | CIF | C41 H40 Cu N6 O9 S0.08 | R 3 :H | 35.023; 35.023; 9.9711 90; 90; 120 | 10592 | Heba Abourahma; Brian Moulton; Victor Kravtsov; Michael J. Zaworotko Supramolecular Isomerism in Coordination Compounds: Nanoscale Molecular Hexagons and Chains Journal of the American Chemical Society, 2002, 124, 9990-9991 |
4115177 | CIF | C15 H24 Cr N3 | R 3 :H | 13.7219; 13.7219; 7.1949 90; 90; 120 | 1173.23 | Louise A. Berben; Jeffrey R. Long Synthesis and Alkali Metal Ion-Binding Properties of a Chromium(III) Triacetylide Complex Journal of the American Chemical Society, 2002, 124, 11588-11589 |
4116599 | CIF | C24 H54 N8 | R 3 :H | 14.555; 14.555; 11.446 90; 90; 120 | 2099.9 | Jineun Kim; Andrew S. Ichimura; Rui H. Huang; Mikhail Redko; Richard C. Phillips; James E. Jackson; James L. Dye Crystalline Salts of Na-and K-(Alkalides) that Are Stable at Room Temperature Journal of the American Chemical Society, 1999, 121, 10666-10667 |
4117952 | CIF | C138 H120 N36 Ni4 O10 S | R 3 :H | 27.4685; 27.4685; 19.581 90; 90; 120 | 12795 | Radu Custelcean; Peter V. Bonnesen; Nathan C. Duncan; Xiaohua Zhang; Lori A. Watson; Gary Van Berkel; Whitney B. Parson; Benjamin P. Hay Urea-Functionalized M4L6 Cage Receptors: Anion-Templated Self-Assembly and Selective Guest Exchange in Aqueous Solutions Journal of the American Chemical Society, 2012, 134, 8525-8534 |
4117953 | CIF | C138 H120 N39 Ni4 O38 P | R 3 :H | 27.5237; 27.5237; 19.5581 90; 90; 120 | 12831.3 | Radu Custelcean; Peter V. Bonnesen; Nathan C. Duncan; Xiaohua Zhang; Lori A. Watson; Gary Van Berkel; Whitney B. Parson; Benjamin P. Hay Urea-Functionalized M4L6 Cage Receptors: Anion-Templated Self-Assembly and Selective Guest Exchange in Aqueous Solutions Journal of the American Chemical Society, 2012, 134, 8525-8534 |
4119243 | CIF | As3 H4 Mn N S6 | R 3 :H | 9.1872; 9.1872; 10.8539 90; 90; 120 | 793.38 | Wei-Wei Xiong; Eashwer Umesh Athresh; Yu Ting Ng; Junfeng Ding; Tom Wu; Qichun Zhang Growing Crystalline Chalcogenidoarsenates in Surfactants: From Zero-Dimensional Cluster to Three-Dimensional Framework Journal of the American Chemical Society, 2013, 135, 1256-1259 |
4119435 | CIF | C45 H69 F6 P Sb | R 3 :H | 13.1739; 13.1739; 23.54 90; 90; 120 | 3538.1 | Xiaobo Pan; Xiaoyu Chen; Tao Li; Yizhi Li; Xinping Wang Isolation and X-ray Crystal Structures of Triarylphosphine Radical Cations Journal of the American Chemical Society, 2013, 135, 3414-3417 |
4120292 | CIF | C66 H66 N35 O17 | R 3 :H | 39.136; 39.136; 26.968 90; 90; 120 | 35771 | Jesús del Barrio; Peter N. Horton; Didier Lairez; Gareth O. Lloyd; Chris Toprakcioglu; Oren A. Scherman Photocontrol over Cucurbit[8]uril Complexes: Stoichiometry and Supramolecular Polymers Journal of the American Chemical Society, 2013, 135, 11760-11763 |
4120423 | CIF | Cd4 Ga5 K Se12 | R 3 :H | 14.362; 14.362; 9.724 90; 90; 120 | 1737 | Hua Lin; Ling Chen; Liu-Jiang Zhou; Li-Ming Wu Functionalization Based on the Substitutional Flexibility: Strong Middle IR Nonlinear Optical Selenides AXII4XIII5Se12 Journal of the American Chemical Society, 2013, 135, 12914-12921 |
4120424 | CIF | Cd4 Ga5 Rb Se12 | R 3 :H | 14.4055; 14.4055; 9.7688 90; 90; 120 | 1755.6 | Hua Lin; Ling Chen; Liu-Jiang Zhou; Li-Ming Wu Functionalization Based on the Substitutional Flexibility: Strong Middle IR Nonlinear Optical Selenides AXII4XIII5Se12 Journal of the American Chemical Society, 2013, 135, 12914-12921 |
4120425 | CIF | Cd4 Cs Ga5 Se12 | R 3 :H | 14.4204; 14.4204; 9.7803 90; 90; 120 | 1761.3 | Hua Lin; Ling Chen; Liu-Jiang Zhou; Li-Ming Wu Functionalization Based on the Substitutional Flexibility: Strong Middle IR Nonlinear Optical Selenides AXII4XIII5Se12 Journal of the American Chemical Society, 2013, 135, 12914-12921 |
4120426 | CIF | Cd4 In5 Rb Se12 | R 3 :H | 14.827; 14.827; 10.0747 90; 90; 120 | 1918.09 | Hua Lin; Ling Chen; Liu-Jiang Zhou; Li-Ming Wu Functionalization Based on the Substitutional Flexibility: Strong Middle IR Nonlinear Optical Selenides AXII4XIII5Se12 Journal of the American Chemical Society, 2013, 135, 12914-12921 |
4120427 | CIF | Cd4 Cs In5 Se12 | R 3 :H | 14.864; 14.864; 10.102 90; 90; 120 | 1932.9 | Hua Lin; Ling Chen; Liu-Jiang Zhou; Li-Ming Wu Functionalization Based on the Substitutional Flexibility: Strong Middle IR Nonlinear Optical Selenides AXII4XIII5Se12 Journal of the American Chemical Society, 2013, 135, 12914-12921 |
4120428 | CIF | In5 Mn4 Rb Se12 | R 3 :H | 14.6793; 14.6793; 9.9732 90; 90; 120 | 1861.1 | Hua Lin; Ling Chen; Liu-Jiang Zhou; Li-Ming Wu Functionalization Based on the Substitutional Flexibility: Strong Middle IR Nonlinear Optical Selenides AXII4XIII5Se12 Journal of the American Chemical Society, 2013, 135, 12914-12921 |
4120429 | CIF | Cs In5 Mn4 Se12 | R 3 :H | 14.7202; 14.7202; 10.0035 90; 90; 120 | 1877.2 | Hua Lin; Ling Chen; Liu-Jiang Zhou; Li-Ming Wu Functionalization Based on the Substitutional Flexibility: Strong Middle IR Nonlinear Optical Selenides AXII4XIII5Se12 Journal of the American Chemical Society, 2013, 135, 12914-12921 |
4121075 | CIF | C16 H39 Na O6 Si3 | R 3 :H | 15.31; 15.31; 9.155 90; 90; 120 | 1858.4 | Hui Li; Adelia J. A. Aquino; David B. Cordes; Fernando Hung-Low; William L. Hase; Clemens Krempner A Zwitterionic Carbanion Frustrated by Boranes - Dihydrogen Cleavage with Weak Lewis Acids via an "Inverse" Frustrated Lewis Pair Approach Journal of the American Chemical Society, 2013, 135, 16066-16069 |
4121366 | CIF | C444 H672 Ga4 K12 N24 O102 | R 3 :H | 25.5125; 25.5125; 67.262 90; 90; 120 | 37915 | Chen Zhao; Qing-Fu Sun; William M. Hart-Cooper; Antonio G. DiPasquale; F. Dean Toste; Robert G. Bergman; Kenneth N. Raymond Chiral Amide Directed Assembly of a Diastereo- and Enantiopure Supramolecular Host and its Application to Enantioselective Catalysis of Neutral Substrates Journal of the American Chemical Society, 2013, 135, 18802-18805 |
4121371 | CIF | C20 H24 N2 | R 3 :H | 21.29; 21.29; 9.79 90; 90; 120 | 3843 | Kohsuke Ohmatsu; Yuichiro Ando; Takashi Ooi Asymmetric Substitution at the Tetrasubstituted Chiral Carbon: Catalytic Ring-Opening Alkylation of Racemic 2,2-Disubstituted Aziridines with 3-Substituted Oxindoles Journal of the American Chemical Society, 2013, 135, 18706-18709 |
4122810 | CIF | C347 H485 Dy12 N48 O83 | R 3 :H | 39.2443; 39.2443; 26.2023 90; 90; 120 | 34948.1 | D'Alessio, Daniel; Sobolev, Alexandre N.; Skelton, Brian W.; Fuller, Rebecca O.; Woodward, Robert C.; Lengkeek, Nigel A.; Fraser, Benjamin H.; Massi, Massimiliano; Ogden, Mark I. Lanthanoid "bottlebrush" clusters: remarkably elongated metal-oxo core structures with controllable lengths. Journal of the American Chemical Society, 2014, 136, 15122-15125 |
4123237 | CIF | C147 H114 Au19 Cl6 F12 N3 O0 P6 Sb2 | R 3 :H | 20.323; 20.323; 31.8618 90; 90; 120 | 11396.6 | Wan, Xian-Kai; Tang, Qing; Yuan, Shang-Fu; Jiang, De-En; Wang, Quan-Ming Au19 nanocluster featuring a v-shaped alkynyl-gold motif. Journal of the American Chemical Society, 2015, 137, 652-655 |
4123786 | CIF | C397 H585 Cl12 N51 O87 | R 3 :H | 26.577; 26.577; 59.934 90; 90; 120 | 36662 | Wu, Xiangxiang; Liu, Rui; Sathyamoorthy, Bharathwaj; Yamato, Kazuhiro; Liang, Guoxing; Shen, Lin; Ma, Sufang; Sukumaran, Dinesh K.; Szyperski, Thomas; Fang, Weihai; He, Lan; Chen, Xuebo; Gong, Bing Discrete stacking of aromatic oligoamide macrocycles. Journal of the American Chemical Society, 2015, 137, 5879-5882 |
4123787 | CIF | C396 H564 Cl9 N39 O87 | R 3 :H | 26.449; 26.449; 59.41 90; 90; 120 | 35992 | Wu, Xiangxiang; Liu, Rui; Sathyamoorthy, Bharathwaj; Yamato, Kazuhiro; Liang, Guoxing; Shen, Lin; Ma, Sufang; Sukumaran, Dinesh K.; Szyperski, Thomas; Fang, Weihai; He, Lan; Chen, Xuebo; Gong, Bing Discrete stacking of aromatic oligoamide macrocycles. Journal of the American Chemical Society, 2015, 137, 5879-5882 |
4125722 | CIF | C252 H258 N30 O21 Zn6 | R 3 :H | 43.652; 43.652; 11.4512 90; 90; 120 | 18896.9 | Dong, Jinqiao; Tan, Chunxia; Zhang, Kang; Liu, Yan; Low, Paul J.; Jiang, Jianwen; Cui, Yong Chiral NH-Controlled Supramolecular Metallacycles. Journal of the American Chemical Society, 2017, 139, 1554-1564 |
4125723 | CIF | C228 H255 N24 O18 Zn6 | R 3 :H | 43.9623; 43.9623; 11.3572 90; 90; 120 | 19009.2 | Dong, Jinqiao; Tan, Chunxia; Zhang, Kang; Liu, Yan; Low, Paul J.; Jiang, Jianwen; Cui, Yong Chiral NH-Controlled Supramolecular Metallacycles. Journal of the American Chemical Society, 2017, 139, 1554-1564 |
4125724 | CIF | C252 H258 N24 O24 Zn6 | R 3 :H | 43.6574; 43.6574; 11.5213 90; 90; 120 | 19017.3 | Dong, Jinqiao; Tan, Chunxia; Zhang, Kang; Liu, Yan; Low, Paul J.; Jiang, Jianwen; Cui, Yong Chiral NH-Controlled Supramolecular Metallacycles. Journal of the American Chemical Society, 2017, 139, 1554-1564 |
4125725 | CIF | C234 H258 N24 O18 Zn6 | R 3 :H | 43.7244; 43.7244; 11.683 90; 90; 120 | 19343.4 | Dong, Jinqiao; Tan, Chunxia; Zhang, Kang; Liu, Yan; Low, Paul J.; Jiang, Jianwen; Cui, Yong Chiral NH-Controlled Supramolecular Metallacycles. Journal of the American Chemical Society, 2017, 139, 1554-1564 |
4126202 | CIF | C16 H38 Cl3 N O7 Zn | R 3 :H | 13.9622; 13.9622; 11.1895 90; 90; 120 | 1889.1 | Li, Wang; He, Chun-Ting; Zeng, Ying; Ji, Cheng-Min; Du, Zi-Yi; Zhang, Wei-Xiong; Chen, Xiao-Ming Crystalline Supramolecular Gyroscope with a Water Molecule as an Ultrasmall Polar Rotator Modulated by Charge-Assisted Hydrogen Bonds. Journal of the American Chemical Society, 2017 |
4126209 | CIF | C180 H566 Cu24 N84 O253 | R 3 :H | 38.2768; 38.2768; 34.6107 90; 90; 120 | 43915 | Mon, Marta; Ferrando-Soria, Jesús; Verdaguer, Michel; Train, Cyrille; Paillard, Charles; Dkhil, Brahim; Versace, Carlo; Bruno, Rosaria; Armentano, Donatella; Pardo, Emilio Postsynthetic Approach for the Rational Design of Chiral Ferroelectric Metal-Organic Frameworks. Journal of the American Chemical Society, 2017, 139, 8098-8101 |
4129364 | CIF | C20 H33 Cl O2 | R 3 :H | 29.89; 29.89; 5.8875 90; 90; 120 | 4555.3 | Daub, Mary Elisabeth; Prudhomme, Jacques; Le Roch, Karine; Vanderwal, Christopher D. Synthesis and potent antimalarial activity of kalihinol B. Journal of the American Chemical Society, 2015, 137, 4912-4915 |
4130510 | CIF | C42 H66 B3 N3 O0.15 | R 3 :H | 15.57; 15.57; 14.579 90; 90; 120 | 3061 | Schäfer, Marius; Beattie, Nicholas A.; Geetharani, K.; Schäfer, Julian; Ewing, William C.; Krahfuß, Mirjam; Hörl, Christian; Dewhurst, Rian D.; Macgregor, Stuart A.; Lambert, Christoph; Braunschweig, Holger Synthesis of Functionalized 1,4-Azaborinines by the Cyclization of Di-tert-butyliminoborane and Alkynes. Journal of the American Chemical Society, 2016, 138, 8212-8220 |
4130518 | CIF | C17 H16 O | R 3 :H | 24.0701; 24.0701; 12.2447 90; 90; 120 | 6143.8 | Clarke, Christopher; Incerti-Pradillos, Celia A; Lam, Hon Wai Enantioselective Nickel-Catalyzed anti-Carbometallative Cyclizations of Alkynyl Electrophiles Enabled by Reversible Alkenylnickel E/Z Isomerization. Journal of the American Chemical Society, 2016, 138, 8068-8071 |
4131624 | CIF | C228 H216 N32 | R 3 :H | 28.1211; 28.1211; 30.4311 90; 90; 120 | 20840.7 | Qu, Hang; Wang, Yu; Li, Zhihao; Wang, Xinchang; Fang, Hongxun; Tian, Zhongqun; Cao, Xiaoyu Molecular Face-Rotating Cube with Emergent Chiral and Fluorescence Properties. Journal of the American Chemical Society, 2017, 139, 18142-18145 |
4131625 | CIF | C228 H216 N32 | R 3 :H | 29.0242; 29.0242; 30.6505 90; 90; 120 | 22360.9 | Qu, Hang; Wang, Yu; Li, Zhihao; Wang, Xinchang; Fang, Hongxun; Tian, Zhongqun; Cao, Xiaoyu Molecular Face-Rotating Cube with Emergent Chiral and Fluorescence Properties. Journal of the American Chemical Society, 2017, 139, 18142-18145 |
4133062 | CIF | C132 H132 N36 O25 Zn13 | R 3 :H | 21.407; 21.407; 29.254 90; 90; 120 | 11610 | Zhao, Xiang; Yang, Huajun; Nguyen, Edward T.; Padilla, Joshua; Chen, Xitong; Feng, Pingyun; Bu, Xianhui Enabling Homochirality and Hydrothermal Stability in Zn<sub>4</sub>O-Based Porous Crystals. Journal of the American Chemical Society, 2018, 140, 13566-13569 |
4133644 | CIF | C17 H19 N3 O6 | R 3 :H | 36.4159; 36.4159; 6.6637 90; 90; 120 | 7652.9 | Bingham, Tanner W.; Hernandez, Lucas W.; Olson, Daniel G.; Svec, Riley L.; Hergenrother, Paul J.; Sarlah, David Enantioselective Synthesis of Isocarbostyril Alkaloids and Analogs Using Catalytic Dearomative Functionalization of Benzene. Journal of the American Chemical Society, 2019, 141, 657-670 |
4133705 | CIF | C44.67 H53.67 B Cl8 F4 Fe N8 O | R 3 :H | 18.6911; 18.6911; 39.1469 90; 90; 120 | 11844 | Keilwerth, Martin; Hohenberger, Johannes; Heinemann, Frank W.; Sutter, Jörg; Scheurer, Andreas; Fang, Huayi; Bill, Eckhard; Neese, Frank; Ye, Shengfa; Meyer, Karsten A Series of Iron Nitrosyl Complexes {Fe-NO}<sup>6-9</sup> and a Fleeting {Fe-NO}<sup>10</sup> Intermediate en Route to a Metalacyclic Iron Nitrosoalkane. Journal of the American Chemical Society, 2019, 141, 17217-17235 |
4134695 | CIF | C60 H120 N16 P4 U | R 3 :H | 20.6977; 20.6977; 14.1093 90; 90; 120 | 5234.6 | Rice, Natalie T.; McCabe, Karl; Bacsa, John; Maron, Laurent; La Pierre, Henry S. Two-Electron Oxidative Atom Transfer at a Homoleptic, Tetravalent Uranium Complex. Journal of the American Chemical Society, 2020, 142, 7368-7373 |
4134696 | CIF | C60 H120 N16 O P4 U | R 3 :H | 20.77; 20.77; 13.975 90; 90; 120 | 5221 | Rice, Natalie T.; McCabe, Karl; Bacsa, John; Maron, Laurent; La Pierre, Henry S. Two-Electron Oxidative Atom Transfer at a Homoleptic, Tetravalent Uranium Complex. Journal of the American Chemical Society, 2020, 142, 7368-7373 |
4134868 | CIF | C64 H128 La4 N32 O80 Rb4 | R 3 :H | 20.4511; 20.4511; 25.0437 90; 90; 120 | 9071.2 | Shi, Chao; Ma, Jia-Jun; Jiang, Jia-Ying; Hua, Miao-Miao; Xu, Qi; Yu, Hui; Zhang, Yi; Ye, Heng-Yun Large Piezoelectric Response in Hybrid Rare-Earth Double Perovskite Relaxor Ferroelectrics. Journal of the American Chemical Society, 2020, 142, 9634-9641 |
4134871 | CIF | C64 H128 La4 N33.33 O80 | R 3 :H | 20.5225; 20.5225; 25.052 90; 90; 120 | 9137.6 | Shi, Chao; Ma, Jia-Jun; Jiang, Jia-Ying; Hua, Miao-Miao; Xu, Qi; Yu, Hui; Zhang, Yi; Ye, Heng-Yun Large Piezoelectric Response in Hybrid Rare-Earth Double Perovskite Relaxor Ferroelectrics. Journal of the American Chemical Society, 2020, 142, 9634-9641 |
4134910 | CIF | C115.01 H107.4 F12 N12.64 O23.65 Ru4 S4 | R 3 :H | 42.315; 42.315; 19.337 90; 90; 120 | 29985 | Singh, Jatinder; Kim, Dong Hwan; Kim, Eun-Hee; Kim, Hyunuk; Hadiputra, Rizky; Jung, Jaehoon; Chi, Ki-Whan The first quantitative synthesis of a closed three‒link chain (6<sup>3</sup><sub>1</sub>) using coordination and non-covalent interactions‒driven self‒assembly. Journal of the American Chemical Society, 2020 |
4135163 | CIF | C10.22 H11.29 N3 O3 Zn | R 3 :H | 27.9529; 27.9529; 10.1479 90; 90; 120 | 6866.9 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135166 | CIF | C7.83 H8.66 N3 O3.21 Zn | R 3 :H | 28.659; 28.659; 10.1251 90; 90; 120 | 7202 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135167 | CIF | C7 H7 N3 O3 Zn | R 3 :H | 28.2634; 28.2634; 10.1714 90; 90; 120 | 7036.6 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135170 | CIF | C9.73 H13.38 N3.91 O3.91 Zn | R 3 :H | 28.8656; 28.8656; 10.1277 90; 90; 120 | 7308.1 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135172 | CIF | C7 H7 N3 O3 Zn | R 3 :H | 28.2673; 28.2673; 10.1143 90; 90; 120 | 6999 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135173 | CIF | C8.9 H9.85 N3.95 O3 Zn | R 3 :H | 27.8332; 27.8332; 10.14011 90; 90; 120 | 6802.99 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135174 | CIF | C8.54 H11.62 N3 O3.77 S0.77 Zn | R 3 :H | 28.3977; 28.3977; 10.1062 90; 90; 120 | 7058.1 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135176 | CIF | C7 H7 N3 O3 Zn | R 3 :H | 24.035; 24.035; 10.2251 90; 90; 120 | 5115.5 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135177 | CIF | C7 H7 N3 O3 Zn | R 3 :H | 27.9972; 27.9972; 10.18666 90; 90; 120 | 6914.99 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135178 | CIF | C8.97 H10.94 N3 O3.66 Zn | R 3 :H | 28.3178; 28.3178; 10.1489 90; 90; 120 | 7048 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135180 | CIF | C7.54 H8.09 N3 O3.27 Zn | R 3 :H | 28.6845; 28.6845; 10.1435 90; 90; 120 | 7227.9 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135181 | CIF | C10.53 H11.41 N3 O3 Zn | R 3 :H | 28.1677; 28.1677; 10.1579 90; 90; 120 | 6979.71 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135182 | CIF | C7 H7 N3 O3 Zn | R 3 :H | 28.1768; 28.1768; 10.1733 90; 90; 120 | 6994.81 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135183 | CIF | C7.69 H8.37 Cl1.37 N3 O3 Zn | R 3 :H | 27.7361; 27.7361; 10.1353 90; 90; 120 | 6752.4 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135184 | CIF | C7 H7 N3 O3 Zn | R 3 :H | 28.9145; 28.9145; 10.1521 90; 90; 120 | 7350.52 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135185 | CIF | C8.44 H9.16 F2.16 N3 O3.72 Zn | R 3 :H | 28.2675; 28.2675; 10.1239 90; 90; 120 | 7005.7 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135186 | CIF | C7 H7 N3 O3 Zn | R 3 :H | 28.3671; 28.3671; 10.1749 90; 90; 120 | 7090.7 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135187 | CIF | C7.74 H8.77 N3 O3.29 Zn | R 3 :H | 28.8315; 28.8315; 10.1304 90; 90; 120 | 7292.8 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135195 | CIF | C8.26 H8.44 N3 O3 Zn | R 3 :H | 28.1471; 28.1471; 10.16708 90; 90; 120 | 6975.8 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135201 | CIF | C12.78 H12.78 N3 O3 Zn | R 3 :H | 28.1915; 28.1915; 10.2028 90; 90; 120 | 7022.4 | Yan, Yong; Carrington, Elliot J.; Pétuya, Rémi; Whitehead, George F. S.; Verma, Ajay; Hylton, Rebecca K.; Tang, Chiu C.; Berry, Neil G.; Darling, George R.; Dyer, Matthew S.; Antypov, Dmytro; Katsoulidis, Alexandros P.; Rosseinsky, Matthew J. Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. Journal of the American Chemical Society, 2020 |
4135584 | CIF | C12 H24 Br2 O6 Zn | R 3 :H | 11.5448; 11.5448; 11.934 90; 90; 120 | 1377.5 | Merzlyakova, Elena; Wolf, Silke; Lebedkin, Sergei; Bayarjargal, Lkhamsuren; Neumeier, B. Lilli; Bartenbach, Daniel; Holzer, Christof; Klopper, Wim; Winkler, Bjoern; Kappes, Manfred; Feldmann, Claus 18-Crown-6 Coordinated Metal Halides with Bright Luminescence and Nonlinear Optical Effects. Journal of the American Chemical Society, 2021, 143, 798-804 |
4135586 | CIF | C12 H24 Br2 Eu O6 | R 3 :H | 11.9296; 11.9296; 11.925 90; 90; 120 | 1469.7 | Merzlyakova, Elena; Wolf, Silke; Lebedkin, Sergei; Bayarjargal, Lkhamsuren; Neumeier, B. Lilli; Bartenbach, Daniel; Holzer, Christof; Klopper, Wim; Winkler, Bjoern; Kappes, Manfred; Feldmann, Claus 18-Crown-6 Coordinated Metal Halides with Bright Luminescence and Nonlinear Optical Effects. Journal of the American Chemical Society, 2021, 143, 798-804 |
4300390 | CIF | F28 O8 Sb4 Xe4 | R 3 :H | 12.9188; 12.9188; 14.6612 90; 90; 120 | 2119.1 | Inorganic Chemistry, 2006 |
4302765 | CIF | C48 H48 Ag12 Cl6 N30 O46 | R 3 :H | 18.5055; 18.5055; 22.556 90; 90; 120 | 6689.5 | Jitendra Kumar; Sandeep Verma Silver-Adenine Metallamacrocyclic Hexamer Inorganic Chemistry, 2009, 48, 6350-6352 |
4303409 | CIF | C41 H95 Mn7 N25 Na O20 | R 3 :H | 15.8536; 15.8536; 22.7938 90; 90; 120 | 4961.4 | Theocharis C. Stamatatos; Dolos Foguet-Albiol; Katye M. Poole; Wolfgang Wernsdorfer; Khalil A. Abboud; Ted A. O'Brien; George Christou Spin Maximization from S= 11 to S= 16 in Mn7 Disk-Like Clusters: Spin Frustration Effects and Their Computational Rationalization Inorganic Chemistry, 2009, 48, 9831-9845 |
4304959 | CIF | C126 H202 O105 Sn2 | R 3 :H | 19.9; 19.9; 43.051 90; 90; 120 | 14764.5 | Shun-Li Li; Ya-Qian Lan; Jian-Fang Ma; Jin Yang; Min Zhang; Zhong-Min Su Unprecedented Dinuclear Tin Derivative of Deprotonated β-Cyclodextrins Inorganic Chemistry, 2008, 47, 2931-2933 |
4305545 | CIF | C117 H98 Br3 Cl4 Cu3 N9 O2 P6 | R 3 :H | 22.8567; 22.8567; 18.0751 90; 90; 120 | 8177.8 | Marlyn Rivera-Carrillo; Indranil Chakraborty; Gellert Mezei; Richard D. Webster; Raphael G. Raptis Tuning of the [Cu3(μ-O)]4+/5+ Redox Couple: Spectroscopic Evidence of Charge Delocalization in the Mixed-Valent [Cu3(μ-O)]5+ Species Inorganic Chemistry, 2008, 47, 7644-7650 |
4305546 | CIF | C117 H98 Cl7 Cu3 N9 O2 P6 | R 3 :H | 22.8405; 22.8405; 17.9558 90; 90; 120 | 8112.3 | Marlyn Rivera-Carrillo; Indranil Chakraborty; Gellert Mezei; Richard D. Webster; Raphael G. Raptis Tuning of the [Cu3(μ-O)]4+/5+ Redox Couple: Spectroscopic Evidence of Charge Delocalization in the Mixed-Valent [Cu3(μ-O)]5+ Species Inorganic Chemistry, 2008, 47, 7644-7650 |
4305547 | CIF | C120 H101 Cl4 Cu3 N9 O5 P6 | R 3 :H | 22.908; 22.908; 17.874 90; 90; 120 | 8123 | Marlyn Rivera-Carrillo; Indranil Chakraborty; Gellert Mezei; Richard D. Webster; Raphael G. Raptis Tuning of the [Cu3(μ-O)]4+/5+ Redox Couple: Spectroscopic Evidence of Charge Delocalization in the Mixed-Valent [Cu3(μ-O)]5+ Species Inorganic Chemistry, 2008, 47, 7644-7650 |
4305548 | CIF | C117 H96 Cl4 Cu3 N12 O7 P6 | R 3 :H | 22.944; 22.944; 17.826 90; 90; 120 | 8126.9 | Marlyn Rivera-Carrillo; Indranil Chakraborty; Gellert Mezei; Richard D. Webster; Raphael G. Raptis Tuning of the [Cu3(μ-O)]4+/5+ Redox Couple: Spectroscopic Evidence of Charge Delocalization in the Mixed-Valent [Cu3(μ-O)]5+ Species Inorganic Chemistry, 2008, 47, 7644-7650 |
4306103 | CIF | C41 H95 Mn7 N25 Na O20 | R 3 :H | 15.8536; 15.8536; 22.7938 90; 90; 120 | 4961.4 | Theocharis C. Stamatatos; Katye M. Poole; Dolos Foguet-Albiol; Khalil A. Abboud; Ted A. O'Brien; George Christou Spin Maximization: Switching of the Usual S= 11 State of MnII4MnIII3 Disklike Complexes to the Maximum S= 16 Inorganic Chemistry, 2008, 47, 6593-6595 |
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