Crystallography Open Database
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Searching space group like 'P n a 21'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
1528541 | CIF | O5 Te Tl V | P n a 21 | 7.313; 8.747; 7.887 90; 90; 90 | 504.506 | Grzechnik, A.; Halasyamani, P.S.; Friese, K.; Chang Hongyoung Twinned crystal structure and compressibility of Tl Te V O4 Journal of Solid State Chemistry, 2009, 182, 1570-1574 |
1528835 | CIF | N6 Pb | P n a 21 | 6.65; 11.37; 16.32 90; 90; 90 | 1233.96 | Saha, P. The Crystal Structure of alpha-Lead Azide, alpha-Pb (N3)2 Indian Journal of Physics and Proceedings of the Indian Association for the Cultivation of Science, 1965, 39, 494-497 |
1529250 | CIF | C16 H16 Cl N O2 | P n a 21 | 7.9657; 14.5166; 12.0126 90; 90; 90 | 1389.08 | Diaba, Faïza; Montiel, Juan A.; Serban, Georgeta; Bonjoch, Josep Synthesis of Normorphans through an Efficient Intramolecular Carbamoylation of Ketones. Organic letters, 2015, 17, 3860-3863 |
1529282 | CIF | C17 H13 Br O2 | P n a 21 | 29.2958; 6.1415; 15.5413 90; 90; 90 | 2796.2 | Kuppusamy, Ramajayam; Gandeepan, Parthasarathy; Cheng, Chien-Hong Rh(III)-Catalyzed [4 + 1] Annulations of 2-Hydroxy- and 2-Aminobenzaldehydes with Allenes: A Simple Method toward 3-Coumaranones and 3-Indolinones. Organic letters, 2015, 17, 3846-3849 |
1529392 | CIF | C32 H36 N2 O2 | P n a 21 | 30.3531; 5.0918; 16.0639 90; 90; 90 | 2482.71 | Takagi, K.; Kato, R.; Yamamoto, S.; Masu, H. Amide-bridged ladder poly(p-phenylene): synthesis by direct arylation and π-stacked assembly Polym. Chem., 2015, 6, 6792 |
1529585 | CIF | Be Fe3 H2 O11 Si3 | P n a 21 | 9.49; 12.23; 7.1 90; 90; 90 | 824.045 | Bakakin, V.V.; Solov'eva, L.P. The crystal structure of Fe3 Be Si3 O9 (F, O H)2 the example of the wollastonitelike silicate chain on the basis of Fe Kristallografiya, 1970, 15, 1144-1151 |
1529643 | CIF | F5 K2 Sm | P n a 21 | 10.8; 6.62; 7.51 90; 90; 90 | 536.935 | Bochkova, R.I.; Belov, N.V.; Saf'yanov, Yu.N.; Kuz'min, E.A. The interpretation of the crystal structure of K2 Sm F5 by the rhombpeak method Doklady Akademii Nauk SSSR, 1973, 212, 357-359 |
1529762 | CIF | Na Nd O4 Si | P n a 21 | 20; 9.28; 5.45 90; 90; 90 | 1011.52 | Chichagov, A.V.; Belov, N.V. The crystal structure of Na Nd Si O4 Geokhimiya, 1968, 1968, 1456-1461 |
1529776 | CIF | S9 Sb4 Sr3 | P n a 21 | 16.579; 24; 4.09 90; 90; 90 | 1627.4 | Cordier, G.; Schwidetzky, C.; Schaefer, H. Sb S3-Tetraederketten und Sb S5-Oktaederketten im Sr3 Sb4 S9 Revue de Chimie Minerale, 1982, 19, 179-186 |
1529780 | CIF | I Li O3 | P n a 21 | 9.4039; 5.8539; 5.2915 90; 90; 90 | 291.294 | Crettez, J.M.; Coquet, E.; Pannetier, J.; Bouillot, J.; Durand-Le Floch, M. Neutron structure refinement of gamma- and beta-lithium: Comparison between alpha, gamma, and beta phases Journal of Solid State Chemistry, 1985, 56, 133-147 |
1529852 | CIF | C43 H37 Br2 Cl Cu N3 O4 P2 | P n a 21 | 19.3661; 14.8237; 28.5913 90; 90; 90 | 8207.9 | Ramakrishna, Kankanala; Murali, Mani; Sivasankar, Chinnappan Chemoselective Carbene insertion into the N-H Bond over O-H Bond Using a Well-Defined Single Site (P-P)Cu(I) Catalyst. Organic letters, 2015, 17, 3814-3817 |
1529900 | CIF | Li O4 P Pb | P n a 21 | 7.969; 18.591; 4.926 90; 90; 90 | 729.795 | Elammari, L.; Elouadi, B.; Depmeier, W. Crystal structure of Li Pb P O4 with "Li4 O13" cluster Journal of Solid State Chemistry, 1988, 76, 266-269 |
1530018 | CIF | C Bi2 O5 | P n a 21 | 5.468; 27.32; 5.468 90; 90; 90 | 816.841 | Greaves, C.; Blower, S.K. Structural relationships between Bi2 O2 C O3 and beta-Bi2 O3 Materials Research Bulletin, 1988, 23, 1001-1008 |
1530065 | CIF | H8 N2 O4 S | P n a 21 | 7.924; 10.526; 5.953 90; 90; 90 | 496.528 | Hasebe, K. Studies of the crystal structure of ammonium sulfate in connection with its ferroelectric phase transition Journal of the Physical Society of Japan, 1981, 50, 1266-1274 |
1530241 | CIF | C8 H4 K4 N8 Nb O2 | P n a 21 | 16.899; 8.821; 11.754 90; 90; 90 | 1752.12 | Laing, M.; Kiernan, P.M.; Gafner, G.; Griffith, W.P. The X-Ray crystal structure of an eight co-ordinate cyanide complex of niobium, K4 Nb (C N)8 (H2 O)2 Inorganica Chimica Acta, 1979, 33, 119-119 |
1530299 | CIF | Na2 O9 P2 U | P n a 21 | 13.259; 8.127; 6.973 90; 90; 90 | 751.382 | Linde, S.A.; Gorbunova, Yu.E.; Pobedina, A.B.; Lavrov, A.V. The synthesis and structure of crystals of sodium uranyl pyrophosphate Na2 U O2 P2 O7 Zhurnal Neorganicheskoi Khimii, 1984, 29, 1533-1537 |
1530305 | CIF | K Ni O4 P | P n a 21 | 8.64; 9.28; 4.93 90; 90; 90 | 395.283 | Ljutin, V.I.; Ilyukhin, V.V.; Tutov, A.G.; Belov, N.B. Crystal structure of antiferromagnetic K, Ni-phosphate K Ni P O4 Doklady Akademii Nauk SSSR, 1973, 208, 346-349 |
1530343 | CIF | Na4 O13 Sc2 Si4 | P n a 21 | 14.442; 5.288; 14.219 90; 90; 90 | 1085.9 | Maksimov, B.A.; Belov, N.V.; Mel'nikov, O.K.; Zhdanova, T.A.; Ilyukhin, V.V. Crystal structure of Na4 Sc2 Si4 O13 Doklady Akademii Nauk SSSR, 1980, 251, 98-102 |
1530418 | CIF | Cs H O3 Se | P n a 21 | 6.431; 14.031; 4.82 90; 90; 90 | 434.925 | Micka, Z.; Danek, M.; Podlahova, J.; Loub, J.; Strauch, B.; Hasek, J. Molecular spectra and X-ray study of the alkali hydrogen selenites M H Se O3 Journal of Solid State Chemistry, 1988, 77, 306-315 |
1530527 | CIF | B3 H8 K3 O10 | P n a 21 | 7.81; 13.71; 8.8 90; 90; 90 | 942.261 | Ozols, J. Crystal structure of potassium triborate K3 (B3 O4 (O H)4 ) * (H2 O)2 = 3 K B O2 (H2 O)1.33 Latvijas PSR Zinatnu Akademijas Vestis, Khimijas Serija, 1977, 1977, 356-357 |
1530606 | CIF | Nb O4 Sb | P n a 21 | 5.557; 4.932; 11.795 90; 90; 90 | 323.267 | Ponomarev, V.I.; Filipenko, O.S.; Venevtsev, Yu.N.; Ivanov, S.A.; Atovmyan, L.O.; Rannev, N.V. Structure and lattice dynamics of Sb Nb O4 crystals at 300-1000 K Kristallografiya, 1981, 26, 341-348 |
1530627 | CIF | Cl3.33333 K2 Zn | P n a 21 | 26.74; 12.399; 7.252 90; 90; 90 | 2404.4 | Quilichini, M.; Schweiss, P.; Heger, G. Neutron structural study of the ferroelectric phase of K2 Zn Cl4 Ferroelectrics, 1988, 79, 117-120 |
1530798 | CIF | H20.68 K1.33 N7.67 O16 P6 Pr | P n a 21 | 25.623; 10.577; 8.632 90; 90; 90 | 2339.4 | Sokol, V.I.; Porai-Koshits, M.A.; Butman, L.A.; Rozanov, I.A.; Berdnikov, V.R. Crystal structure of potassium ammonium bis(trimetaphosphimato)- praseodymate, K1.3 (N H4)1.7 (Pr ((P O2 N H)3)2) (H2 O)8 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1979, 5, 1093-1102 |
1530815 | CIF | H24 N11 O16 Rh2 | P n a 21 | 14.997; 11.952; 10.489 90; 90; 90 | 1880.09 | Springborg, J.; Zehnder, M. Synthesis and crystal structure of a peroxo-bridged binuclear Rhodium(III) complex and its superoxo-bridged analogue Helvetica Chimica Acta, 1984, 67, 2218-2225 |
1530973 | CIF | O5 P W | P n a 21 | 11.174; 6.55; 5.228 90; 90; 90 | 382.636 | Wang, S.-L.; Wang, C.-C.; Lii, K.-H. Crystal Structure of W P O5, the Second Member of the Monophosphate Tungsten Bronze Series (W O3)2m (P O2)4 Journal of Solid State Chemistry, 1989, 82, 298-302 |
1531000 | CIF | Mn N2 Si | P n a 21 | 5.248; 6.511; 5.07 90; 90; 90 | 173.241 | Wintenberger, M.; Marchand, R.; Maunaye, M. Etude cristallographique et magnetique de Mn Si N2 par diffraction des neutrons Solid State Communications, 1977, 21, 733-735 |
1531005 | CIF | K2 O4 Se | P n a 21 | 22.716; 10.339; 5.967 90; 90; 90 | 1401.41 | Yamada, N.; Ono, Y.; Ikeda, T. A Structural Study of the Incommensurate-to-Ferroelectric Phase Transition in K2 Se O4 Journal of the Physical Society of Japan, 1984, 53, 2565-2574 |
1531042 | CIF | C15 H22 N O4 V | P n a 21 | 14.7897; 13.1867; 7.8841 90; 90; 90 | 1537.62 | Gazi, Sarifuddin; Hung Ng, Wilson Kwok; Ganguly, Rakesh; Putra Moeljadi, Adhitya Mangala; Hirao, Hajime; Soo, Han Sen Selective photocatalytic C‒C bond cleavage under ambient conditions with earth abundant vanadium complexes Chem. Sci., 2015, 6, 7130 |
1531265 | CIF | Er0.017 Nb0.056 O5 P Rb Ti0.927 | P n a 21 | 12.9716; 6.5069; 10.574 90; 90; 90 | 892.497 | Carvajal, J.J.; Aguilo, M.; Garcia-Munoz, J.L.; Sole, R.; Gavalda, J.; Massons, J.; Diaz, F. Selective dstribution of dopants among M O6 octahedra in Rb Ti0.927 Nb0.056 Er0.017 O P O4 : a neutron diffraction study Journal of Solid State Chemistry, 2003, 171, 257-261 |
1531577 | CIF | Cl5 Co H15 N5 Pd | P n a 21 | 16.344; 9.424; 7.968 90; 90; 90 | 1227.28 | Koz'min, P.A.; Surazhskaya, M.D.; Bol'shakova, M.D.; Bol'shakov, A.M. Structure of pentaamminechlorocobalt(III) tetrachloropalladate(II) (Co (N H3)5 Cl) (Pd Cl4) Zhurnal Neorganicheskoi Khimii, 2001, 46, 1639-1641 |
1531588 | CIF | Ga Li S2 | P n a 21 | 6.5133; 7.8629; 6.2175 90; 90; 90 | 318.419 | Isaenko, L.; Yelisseyev, A.; Lobanov, S.; Titov, A.; Petrov, V.; Smirnova, J.; Vedenyapin, V.; Merkulov, A.; Zondy, J.J.; Krinitsin, P. Growth and properties of Li Ga X2 (X = S, Se, Te) single crystals for nonlinear optical applications in the mid-IR Crystal Research and Technology, 2003, 38, 379-387 |
1531591 | CIF | Ga Li Se2 | P n a 21 | 6.832; 8.237; 6.535 90; 90; 90 | 367.758 | Isaenko, L.; Yelisseyev, A.; Smirnova, J.; Petrov, V.; Titov, A.; Lobanov, S.; Zondy, J.J.; Vedenyapin, V.; Merkulov, A.; Krinitsin, P. Growth and properties of Li Ga X2 (X = S, Se, Te) single crystals for nonlinear optical applications in the mid-IR Crystal Research and Technology, 2003, 38, 379-387 |
1531797 | CIF | Ca Ga La O4 | P n a 21 | 11.8083; 5.3529; 6.8603 90; 90; 90 | 433.63 | Li, Z.-F.; Li, G.-B.; Lin, J.-H.; Liao, F.-H. On the synthesis and structure of La Ca Ga O4 Journal of Solid State Chemistry, 2003, 172, 59-65 |
1531887 | CIF | Cs2 H4 O12 Se2 U | P n a 21 | 14.367; 11.682; 7.826 90; 90; 90 | 1313.48 | Mikhailov, Yu.N.; Gorbunova, Yu.E.; Shishkina, O.V.; Serezhkin, V.N.; Serezhkina, L.B. Crystal structure of Cs2 ((U O2 (Se O4)2) * (H2 O)) * (H2 O) Zhurnal Neorganicheskoi Khimii, 2001, 46, 1828-1832 |
1532252 | CIF | Fe0.5 La4 Nb0.5 O14 Ti3 | P n a 21 | 25.772; 7.834; 5.545 90; 90; 90 | 1119.52 | Titov, Yu.O.; Sych, A.M.; Belyavina, N.M.; Kapshuk, A.O.; Markiv, V.Ya. Localization of heteroatoms Fe and Nb in the layered structure of ferroelectric La4 Ti4 O14 Dopov. Nats. Akad. Nauk. Ukr., 2002, 2002, 162-166 |
1532414 | CIF | D Nd Ni Sn | P n a 21 | 7.21707; 8.39695; 4.35618 90; 90; 90 | 263.991 | Yartys', V.A.; Olavesen, T.; Hauback, B.C.; Fjellvag, H. Orthorhombic Nd Ni Sn D with filled (Ti Ni Si)-type structure Journal of Alloys Compd., 2002, 336, 181-186 |
1532447 | CIF | Nb0.67 O4 Sb Ta0.33 | P n a 21 | 5.557; 4.932; 11.808 90; 90; 90 | 323.623 | Zubkova, N.V.; Tillmanns, E.; Pushcharovskii, D.Yu.; Giester, G.; Smolin, A.S.; Kashaev, A.A.; Peretyazhko, I.S.; Brandstaetter, F.; Sapozhnikov, A.N.; Hammer, V. Bismutocolumbite, Bi (Nb0.79 Ta0.21) O4, stibiocolumbite, Sb (Nb0.67 Ta0.33) O4 and their structural relation to the other A B O4 minerals with stibiotantalite (Sb Ta O4) structure Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-), 2002, 2002, 145-159 |
1532572 | CIF | Bi Cl O3 Se | P n a 21 | 11.707; 7.047; 5.315 90; 90; 90 | 438.483 | Ibragimov, S.A.; Berdonosov, P.S.; Dolgikh, V.A.; Huong, D.Q.; Oppermann, H. Crystal structure and SHG characterization of gamma-(Bi Se O3 Cl) Neorganicheskie Materialy, 2002, 38, 1514-1519 |
1532954 | CIF | H6 O15 Re3 Sm | P n a 21 | 14.776; 8.468; 11.505 90; 90; 90 | 1439.54 | Mujica, C.; Cardoso-Gil, R.; Sanchez, V.; Llanos, J.; Schnelle, W. Crystal structure and thermal stability of Sm (Re O4)3 (H2 O)3 Journal of Alloys Compd., 2004, 364, 89-92 |
1532993 | CIF | Cr0.019 K0.981 O5 P Ti | P n a 21 | 12.878; 6.406; 10.641 90; 90; 90 | 877.845 | Kannan, C.V.; Righi, L.; Ganesamoorthy, S.; Ramasamy, P.; Bocelli, G. Growth, structural and optical studies of chromium doped K Ti O P O4 single crystals Journal of Crystal Growth, 2003, 252, 328-332 |
1533267 | CIF | Ce D Ni Sn | P n a 21 | 7.238; 8.446; 4.398 90; 90; 90 | 268.859 | Yartys', V.A.; Ouladdiaf, B.; Isnard, O.; Khyzhun, O.Yu.; Buschow, K.H.J. Hydrogen induced antiferromagnetism in the Kondo semimetal Ce Ni Sn Journal of Alloys Compd., 2003, 359, 62-65 |
1533304 | CIF | Cl H4 N O4 | P n a 21 | 9.22; 7.458; 5.814 90; 90; 90 | 399.787 | Zhang Jianguo; Zhang Tonglai; Yang Li A study of crystal structure and explosive properties of ammonium perchlorate Huozhayao Xuebao, 2002, 25, 33-34 |
1533305 | CIF | Al Li O4 Si | P n a 21 | 9.938; 6.569; 4.948 90; 90; 90 | 323.019 | Ceriani, C.; Fois, E.; Gamba, A. The role of extra-framework cations on the structure of dehydrated Li-ABW. A computer simulation study Microporous and Mesoporous Materials, 2003, 57, 73-81 |
1533378 | CIF | H Na O5 Si2 | P n a 21 | 27.32; 15.4; 8.241 90; 90; 90 | 3467.22 | Sassi, M.; Gramlich, V.; Josien, L.; Miehe-Brendle, J.; Paillaud, J.-L.; Benggedach, A.; Patarin, J. Synthesis and characterization of a new one-dimensional sodium silicate named Mu-29 Microporous and Mesoporous Materials, 2003, 64, 51-61 |
1533454 | CIF | Ag2 Ge3 H2 K4 O S9 | P n a 21 | 12.4524; 9.6339; 16.5636 90; 90; 90 | 1987.06 | An Yonglin; Menghe Baiyin; Ye Ling; Ji Min; Jia Cuiying; Liu Xin A solvothermal synthesis and characterization of a new open-framework K4 Ag2 Ge3 Se9 * (H2 O) Journal of Solid State Chemistry, 2004, 177, 2506-2510 |
1533700 | CIF | C2 H28 N6 O21 P4 V3 | P n a 21 | 19.0766; 9.1657; 14.1806 90; 90; 90 | 2479.48 | Harrison, W.T.A. (C N3 H6)2 * (V O)3 (H2 O)3 (H P O3)4 * 3(H2 O), a guanidinium vanadium phosphite hydrate based on a (3,4) connected net: an "orthogonal templating" effect? Solid State Sciences, 2003, 5, 297-302 |
1534147 | CIF | K0.89 Nb0.11 O5 P Ti0.89 | P n a 21 | 12.815; 6.415; 10.591 90; 90; 90 | 870.667 | Alekseeva, O.A.; Sorokina, N.I.; Verin, I.A.; Yanovskii, V.K.; Lozevskaya, T.Yu.; Voronkova, V.I.; Simonov, V.I. Structure and properties of potassium titanyl phosphate single crystals with 7 and 11 at.% Nb Kristallografiya, 2003, 48, 238-245 |
1534502 | CIF | F6 K Na Sn | P n a 21 | 11.8; 6; 8.125 90; 90; 90 | 575.25 | Gerasimenko, A.V.; Sergienko, V.I.; Ivanov, S.B.; Antokhina, T.F. Crystal structure of NaKSnF6 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1992, 18, 129-132 |
1534588 | CIF | I Li O3 | P n a 21 | 9.422; 5.861; 5.301 90; 90; 90 | 292.734 | Liminga, R.; Svensson, C.; Albertsson, J.; Abrahams, S.C. gamma-lithium iodate at 515 K and the alpha-Li I O3 to gamma-Li I O3, gamma-Li I O3 to beta-Li I O3 phase transitions Journal of Chemical Physics, 1982, 77, 4222-4226 |
1534596 | CIF | Cl8 Ga2 Sb8 | P n a 21 | 17.549; 9.9173; 12.858 90; 90; 90 | 2237.79 | Lindsjoe, M.; Fischer, A.; Kloo, L. Sb8 (Ga Cl4)2: Isolation of a homopolyatomic antimony cation Angew. Chem. Int. ed., 2004, 43, 2540-2543 |
1534821 | CIF | B3 Li O5 | P n a 21 | 8.746; 7.48; 5.013 90; 90; 90 | 327.951 | Shepelev, Yu.F.; Filatov, S.K.; Bubnova, R.S.; Sennova, N.A.; Pilneva, N.A. Li B3 O5 crystal structure at 20, 227, and 377 degree C Journal of Solid State Chemistry, 2005, 178, 2987-2997 |
1534938 | CIF | C H11 B12 Cs2 N S | P n a 21 | 9.605; 10.183; 14.393 90; 90; 90 | 1407.75 | Sivaev, I.B.; Katser, S.B.; Solntsev, K.A.; Kuznetsov, N.T. Some features of (B12 H11 S C N)2- anion. Crystal structure of cesium (thiocyanato)undecahydro(Ih-(1551)-delta20-closo)-dodeca borate Cs2 (B12 H11 S C N) Zhurnal Neorganicheskoi Khimii, 1995, 40, 807-810 |
1534976 | CIF | Ba H4 N2 O6 S2 | P n a 21 | 10.579; 13.416; 4.829 90; 90; 90 | 685.37 | Manickkavachagam, R.; Chandrasekaran, K. S.; Rajaram, R. K. Crystal Structure of Barium Sulphamate Current Science, 1983, 52, 420-421 |
1535069 | CIF | Ge K O5 Sb | P n a 21 | 13.224; 6.597; 10.759 90; 90; 90 | 938.601 | Belokoneva, E.L.; Mill', B.V.; Butashin, A.V. Synthesis of germanates and silicates with the structure K Ti O P O4 and crystalline structure of K Sb O Ge O4 Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy, 1991, 27, 1708-1713 |
1535087 | CIF | Ge0.063 K O5 P Ti0.937 | P n a 21 | 12.7633; 6.3992; 10.4988 90; 90; 90 | 857.489 | Sorokina, N.I.; Simonov, V.I.; Voronkova, V.I.; Verin, I.A.; Yanovskii, V.K. Crystal structure and electrophysical characteristics of K Ge0.06 Ti0.94 O P O4 single crystals Kristallografiya, 1995, 40, 688-691 |
1535091 | CIF | Ge0.042 K O5 P Ti0.958 | P n a 21 | 12.7788; 6.4002; 10.5268 90; 90; 90 | 860.954 | Sorokina, N.I.; Voronkova, V.I.; Verin, I.A.; Yanovskii, V.K.; Simonov, V.I. Crystal structures of compounds in the K Ti O P O4 K Ge O P O4 system. Kristallografiya, 1996, 41, 457-460 |
1535095 | CIF | Ge0.184 K O5 P Ti0.816 | P n a 21 | 12.7252; 6.3944; 10.4212 90; 90; 90 | 847.973 | Sorokina, N.I.; Voronkova, V.I.; Simonov, V.I.; Yanovskii, V.K.; Verin, I.A. Crystal structures of compounds in the K Ti O P O4 K Ge O P O4 system. Kristallografiya, 1996, 41, 457-460 |
1535096 | CIF | Ge K O5 Ta | P n a 21 | 13.386; 6.658; 10.997 90; 90; 90 | 980.096 | Belokoneva, E.L.; Mill', B.V. Crystal structures of K Ta O Ge O4 and Rb Sb O Ge O4. Zhurnal Neorganicheskoi Khimii, 1992, 37, 998-1003 |
1535099 | CIF | Ge O5 Rb Sb | P n a 21 | 13.382; 6.708; 10.746 90; 90; 90 | 964.63 | Belokoneva, E.L.; Mill', B.V. Crystal structures of K Ta O Ge O4 and Rb Sb O Ge O4. Zhurnal Neorganicheskoi Khimii, 1992, 37, 998-1003 |
1535112 | CIF | Ge O5 Sb Tl | P n a 21 | 13.358; 6.664; 10.762 90; 90; 90 | 958.009 | Belokoneva, E.L.; Dolgushin, F.M.; Antipin, M.Yu.; Mill', B.V.; Struchkov, Yu.T. Study of phase transition in Tl Sb O Ge O4 crystals in the temperature range 123-293 K Zhurnal Neorganicheskoi Khimii, 1993, 38, 631-636 |
1535120 | CIF | Ge Na O5 Sb | P n a 21 | 13.008; 6.433; 10.736 90; 90; 90 | 898.393 | Belokoneva, E.L.; Mill', B.V. Crystal structures of beta-NaSbOGeO4 and AgSbOSiO4 and migration paths of ions in structures of KTiOPO4 type Zhurnal Neorganicheskoi Khimii, 1994, 39, 355-362 |
1535222 | CIF | C Br5 K2 O Os | P n a 21 | 14.294; 7.304; 10.677 90; 90; 90 | 1114.71 | Berngardt, E.A.; Buslaev, Yu.A.; Gorbunova, Yu.E.; Mikhailov, Yu.N.; Kanishcheva, A.S.; Sinitsyn, N.M. Synthesis and crystal structure of potassium monocarbonylpentabromoosmate K2 (Os C O Br5) Zhurnal Neorganicheskoi Khimii, 1995, 40, 92-93 |
1535523 | CIF | Cu Hg I S | P n a 21 | 7.1748; 8.3356; 6.9855 90; 90; 90 | 417.777 | Moro'oka, M.; Ohki, H.; Yamada, K.; Okuda, T. The crystal structure, phase transition and electric conductivity of new quaternary chalcogenide halide Cu Hg S I Journal of Solid State Chemistry, 2004, 177, 1401-1404 |
1535609 | CIF | F H3 O4 P Rb | P n a 21 | 9.055; 4.635; 11.908 90; 90; 90 | 499.778 | Troyanov, S.I.; Snigireva, E.M.; Feist, M.; Kemnitz, E. Kristallstruktur und thermisches Verhalten von Metalldihydrogenphosphat-H F-Addukten M H2 P O4 * H F (M= K, Rb, Cs) mit Wasserstoffbindungen vom Typ F-H...O Zeitschrift fuer Anorganische und Allgemeine Chemie, 2001, 627, 1687-1692 |
1535667 | CIF | Ga Na O2 | P n a 21 | 5.498; 7.206; 5.298 90; 90; 90 | 209.899 | Mueller, H.; Hoppe, R. Zur Kristallstruktur von KGaO2 und NaGaO2(II) Zeitschrift fuer Anorganische und Allgemeine Chemie, 1992, 611, 73-80 |
1535729 | CIF | Li O4 P Pb | P n a 21 | 7.982; 18.626; 4.938 90; 90; 90 | 734.146 | Trunov, V.K.; Makarevich, L.G.; Oboznenko, Yu.V.; Tskhelashvili, N.B.; Sirotkin, S.P. Crystal structure of Li Pb P O4 Kristallografiya, 1990, 35, 205-208 |
1535781 | CIF | Ca0.603333 O4 Si Sr1.39667 | P n a 21 | 20.863; 9.5; 5.6005 90; 90; 90 | 1110.01 | Il'inets, A.M.; Bikbau, M.Ya. Structural mechanism of polymorphic transformations of dicalcium silicate-Ca2SiO4.Part II. Refinement of crystal structure of high-temperature alpha'modification of dicalcium silicate Ca2SiO4. Kristallografiya, 1990, 35, 91-93 |
1535872 | CIF | Dy K O8 Se2 | P n a 21 | 27.47; 5.657; 8.989 90; 90; 90 | 1396.87 | Ishakova, L.D.; Trunov, V.K.; Ovanisyan, S.M. Crystal structure of K Dy (Se O4)2 Kristallografiya, 1990, 35, 1099-1104 |
1535904 | CIF | Be N2 Si | P n a 21 | 4.977; 5.747; 4.674 90; 90; 90 | 133.69 | Eckerlin, P. Die Kristallstruktur von Be Si N2 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1967, 353, 225-235 |
1536119 | CIF | Cl2.556 H4.5 Li5.88 N22 O2 P12 | P n a 21 | 4.753; 14.208; 8.203 90; 90; 90 | 553.954 | Correll, S.; Oeckler, O.; Stock, N.; Schnick, W. Li(x) H(12-x-y+z) (P12 O(y) N(24-y)) Cl(z) - An oxonitridophosphate with a zeolitelike framework structure composed of 3-rings Angewandte Chemie (Edition international), 2003, 42, 3549-3552 |
1536128 | CIF | Ge K O5 P | P n a 21 | 12.6013; 6.3051; 10.0031 90; 90; 90 | 794.771 | Voronkova, V.I.; Yanovskii, V.K.; Sorokina, N.I.; Verin, I.A.; Simonov, V.I. Ferroelectric phase transition and crystal structure of KGeOPO4 Kristallografiya, 1993, 38, 147-151 |
1536133 | CIF | K0.59 O5 P Ti Tl0.41 | P n a 21 | 12.879; 6.434; 10.588 90; 90; 90 | 877.359 | Voronkova, V.I.; Sorokina, N.I.; Li, D.Y.; Yanovskii, V.K.; Simonov, V.I.; Furmanova, N.G.; Verin, I.A. Atomic structure and electrophysical characteristics of K0.59Tl0.41TiOPO4 single crystals Kristallografiya, 1994, 39, 430-433 |
1536144 | CIF | Cl3.68 H9.2 Li6.48 N24 P12 | P n a 21 | 4.766; 14.263; 8.235 90; 90; 90 | 559.794 | Correll, S.; Stock, N.; Schnick, W.; Nilges, T.; Oeckler, O.; Senker, J. Li(x) H(12-x-y+z) (P12 O(y) N(24-y))X(z) (X = Cl, Br) - Oxonitridophosphate mit NPO-Zeolithstruktur Zeitschrift fuer Anorganische und Allgemeine Chemie, 2004, 630, 2205-2217 |
1536369 | CIF | Hg2 O5 Te | P n a 21 | 7.3462; 5.8635; 9.969 90; 90; 90 | 429.409 | Weil, M. Preparation, Thermal Behaviour and Crystal Structure of the Basic Mercury(II) Tetraoxotellurate(VI), Hg2TeO5, and Redetermination of the Crystal Structure of Mercury(II) Orthotellurate(VI), Hg3TeO6 Zeitschrift fuer Anorganische und Allgemeine Chemie, 2003, 629, 653-657 |
1536446 | CIF | Cu Hg I S | P n a 21 | 7.183; 8.343; 6.989 90; 90; 90 | 418.835 | Keller, H.L.; Wimbert, L. Ueber Muenzmetall - Quecksilber - Chalkogenidhalogenide. IV. Hydrothermalsynthese und Kristallstruktur von Cu Hg S I und Cu Hg2 S2 I Zeitschrift fuer Anorganische und Allgemeine Chemie, 2004, 630, 331-336 |
1536652 | CIF | Cl Co H15 N7 O5 | P n a 21 | 14.828; 9.599; 7.289 90; 90; 90 | 1037.47 | Podberezskaya, N.V.; Virovets, A.V.; Boldyreva, E.V. Comparative study of crystal structures in (M (N H3)5 N O2) X Y and(M (N H3)5 O N O) X Y series. Crystal structure of (Co (N H3)5 N O2) Cl * (N O3) Zhurnal Strukturnoi Khimii (Issue-No. from 1981), 1991, 32, 89-95 |
1536697 | CIF | H22 Na3 O12 P S3 | P n a 21 | 12.621; 9.477; 14.3122 90; 90; 90 | 1711.87 | Pompetzki, M.; Jansen, M. Crystal structures of Na3 P O2 S2 * 11(H2 O) and Na3 P O S3 * 11(H2 O) Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-), 2002, 133, 975-986 |
1536754 | CIF | Cs Mn O4 P | P n a 21 | 9.128; 9.575; 5.595 90; 90; 90 | 489.006 | Yakubovich, O.V.; Simonov, M.A.; Mel'nikov, O.K. Crystal structure of CsMnPO4 Kristallografiya, 1990, 35, 42-46 |
1537257 | CIF | C Br2 Se4 | P n a 21 | 21.169; 4.176; 8.496 90; 90; 90 | 751.061 | Larsen, S.; Henriksen, L. 1,2,3-triselenetan-4-(Se,Se-dibromoselone); C Br2 Se4, crystal structure and mechanism of formation Acta Chemica Scandinavica, Series A: (28,1974-), 1984, 38, 289-296 |
1537521 | CIF | C6 H24 Cl5 Cu N3 | P n a 21 | 11.338; 9.981; 15.675 90; 90; 90 | 1773.85 | Kirpichnikova, L.F.; Pietraszko, A.; Bednarski, W.; Sheleg, A.U.; Waplak, S. Crystal structure and phase transitions in the new crystals of ((C H3)2 N H2)2 Cu Cl4 ((C H3)2 N H2) Cl Kristallografiya, 2004, 49, 92-100 |
1537557 | CIF | K O5 P Sn0.53 Ti0.47 | P n a 21 | 12.993; 6.471; 10.661 90; 90; 90 | 896.352 | Krotova, O.D.; Sorokina, N.I.; Verin, I.A.; Voronkova, V.I.; Yanovskii, V.K.; Simonov, V.I. Structure and properties of single crystals of tin-doped potassium titanyl phosphate Kristallografiya, 2003, 48, 992-999 |
1537558 | CIF | K O5 P Sn0.75 Ti0.25 | P n a 21 | 13.076; 6.504; 10.69 90; 90; 90 | 909.145 | Krotova, O.D.; Sorokina, N.I.; Verin, I.A.; Voronkova, V.I.; Yanovskii, V.K.; Simonov, V.I. Structure and properties of single crystals of tin-doped potassium titanyl phosphate Kristallografiya, 2003, 48, 992-999 |
1539599 | CIF | Cu2 O5 Y2 | P n a 21 | 10.805; 3.4955; 12.4605 90; 90; 90 | 470.619 | Aride, J.; Flandrois, S. New investigations on magnetic and neutron diffraction properties of Y2Cu2 O5 and related oxides Solid State Communications, 1989, 72, 459-463 |
1539607 | CIF | Mo4 O11 | P n a 21 | 24.49; 6.752; 5.457 90; 90; 90 | 902.35 | Asbrink, S.; Kihlborg, L. A study of the crystal symmetry and structure of orthorhombic Mo4 O11 by least-squares techniques Acta Chemica Scandinavica (1-27,1973-42,1988), 1964, 18, 1571-1573 |
1539958 | CIF | Cr O4 Sr2 | P n a 21 | 14.182; 5.788; 10.1 90; 90; 90 | 829.063 | Wilhelmi, K.A. The crystal structure of strontium chromate(IV), Sr2 Cr O4 Arkiv foer Kemi, 1967, 26, 157-165 |
1540330 | CIF | Al O4 Si Tl1.1 | P n a 21 | 8.297; 9.417; 5.413 90; 90; 90 | 422.933 | Krogh Andersen, I.G.; Krogh Andersen, E.; Norby, P.; Colella, C.; de'Gennaro, M. Synthesis and structure of an ABW type thallium alumosilicate Zeolites, 1991, 11, 149-154 |
1540601 | CIF | C20 H21 N O2 | P n a 21 | 7.5747; 10.8659; 20.7341 90; 90; 90 | 1706.54 | Karmakar, Raju; Suneja, Arun; Bisai, Vishnumaya; Singh, Vinod K. Ni(II)-Catalyzed Highly Stereo- and Regioselective Syntheses of Isoindolinones and Isoquinolinones from in Situ Prepared Aldimines Triggered by Homoallylation/Lactamization Cascade. Organic letters, 2015, 17, 5650-5653 |
1540651 | CIF | C11 H24 Br2 Fe N4 | P n a 21 | 16.3535; 12.5257; 7.6117 90; 90; 90 | 1559.2 | Nakanishi, So-ichiro; Kawamura, Mitsunobu; Sunada, Yusuke; Nagashima, Hideo Atom transfer radical polymerization by solvent-stabilized (Me3TACN)FeX2: a practical access to reusable iron(ii) catalysts Polym. Chem., 2016, 7, 1037 |
1540735 | CIF | C14 H12 N2 O4 | P n a 21 | 10.2721; 12.99; 9.383 90; 90; 90 | 1252 | Piechowicz, Marek; Abney, Carter W.; Zhou, Xin; Thacker, Nathan C.; Li, Zhong; Lin, Wenbin Design, Synthesis, and Characterization of a Bifunctional Chelator with Ultrahigh Capacity for Uranium Uptake from Seawater Simulant Industrial & Engineering Chemistry Research, 2016, 55, 4170 |
1540872 | CIF | Li P5 | P n a 21 | 10.439; 6.584; 6.545 90; 90; 90 | 449.84 | von Schnering, H.G.; Wichelhaus, W. Die Lithiumphosphide Li P5 und Li P7 Naturwissenschaften, 1972, 59, 78-79 |
1541006 | CIF | Ba H6 O5 Zn | P n a 21 | 11.786; 17.9719; 7.9336 90; 90; 90 | 1680.47 | Stahl, R.; Jacobs, H. Synthese und Kristallstruktur von Ba Zn (O H)4 . (H2 O) Zeitschrift fuer Anorganische und Allgemeine Chemie, 1998, 624, 21-24 |
1541071 | CIF | Na O5 Sb Si | P n a 21 | 12.799; 6.324; 10.606 90; 90; 90 | 858.459 | Pagnoux, C.; Favard, J.F.; Piffard, Y.; Verbaere, A.; Tournoux, M. Crystal structure of Na Sb O Si O4 Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie 2 (1984-1993), 1992, 314, 151-155 |
1541296 | CIF | D1.8 Ga Li O4.9 Si | P n a 21 | 10.5659; 8.2053; 5.0247 90; 90; 90 | 435.623 | Newsam, J.M. Synthesis and structural characterization of a lithium gallosilicate with the zeolite abw framework Journal of Physical Chemistry, 1988, 92, 445-452 |
1541297 | CIF | D2 Ga Li O5 Si | P n a 21 | 10.465; 8.2113; 5.0268 90; 90; 90 | 431.959 | Newsam, J.M. Synthesis and structural characterization of a lithium gallosilicate with the zeolite abw framework Journal of Physical Chemistry, 1988, 92, 445-452 |
1541424 | CIF | C18 O18 Pt2 Ru4 | P n a 21 | 17.738; 15.596; 10.357 90; 90; 90 | 2865.18 | Antonucci, V.; Arico, A.S.; Marchetti, F.; Calderazzo, F.; Labella, L. A new polymorph of the heteronuclear cluster Ru4 Pt2 (C O)18 Journal of Cluster Science, 2001, 12, 293-301 |
1541510 | CIF | C4 H15 Cs N2 Na O9.5 S4 | P n a 21 | 28.325; 10.812; 11.047 90; 90; 90 | 3383.14 | Moers, O.; Blaschette, A.; Jones, P.G. Polysulfonylamine.CLXII.Kristallstrukturen von Metall-di(sulfonyl)amiden. Das orthorhombische Doppelsalz Na2 Cs2 ((C H3 S O2)2 N)4 . 3(H2 O): ein dreidimensionales Koordinationspolymer aus (Caesium-Anion-Wasser)-Schichten und intercalierten Natriumionen. Zeitschrift fuer Anorganische und Allgemeine Chemie, 2003, 629, 989-997 |
1541800 | CIF | C5 H8 Cu2 N4 | P n a 21 | 13.504; 7.4447; 8.2059 90; 90; 90 | 824.966 | Pretsch, T.; Bruedgam, I.; Hartl, H. Konformation und Vernetzung von (Cu C N)6 - Ringen in polymeren Cyanocupraten(I) (infty n)(Cu2 (C N)(3))(-) (n = 2, 3) Zeitschrift fuer Anorganische und Allgemeine Chemie, 2004, 630, 353-360 |
1541848 | CIF | C5 K3 N5 O V | P n a 21 | 13.47; 8.5292; 9.7818 90; 90; 90 | 1123.81 | Jagner, S.; Vannerberg, N.G. The crystal structure of potassium oxopentacyanovanadate(IV), K3 (V O (C N)5) Acta Chemica Scandinavica (1-27,1973-42,1988), 1973, 27, 3482-3498 |
1541973 | CIF | Cl4 H10 N2 O Sn | P n a 21 | 12.331; 8.379; 9.293 90; 90; 90 | 960.166 | Harrison, P.G.; Haylett, B.J.; King, T.J. The Crystal and Molecular Structure of Di-Ammonium Trichlorostannate(II) Chloride Monohydrate. Structural Correlations for Chlorotin(II) Derivatives Inorganica Chimica Acta, 1983, 75, 265-270 |
1541984 | CIF | C H17 Br Co N5 O4 | P n a 21 | 12.37; 12.144; 6.433 90; 90; 90 | 966.373 | Freeman, H.C.; Robinson, G. The Crystal Structure of Carbonatopenta-ammine-cobalt(III) Bromide Hydrate Journal of the Chemical Society, 1965, 1965, 3194-3200 |
1542323 | CIF | C68 H37 Co N19 | P n a 21 | 18.9411; 8.6917; 33.5158 90; 90; 90 | 5517.7 | Zhang, Xuan; Wang, Zhao-Xi; Xie, Haomiao; Li, Ming-Xing; Woods, Toby J.; Dunbar, Kim R. A cobalt(ii) spin-crossover compound with partially charged TCNQ radicals and an anomalous conducting behavior Chem. Sci., 2016, 7, 1569 |
1542324 | CIF | C68 H37 Co N19 | P n a 21 | 19.087; 8.742; 33.634 90; 90; 90 | 5612 | Zhang, Xuan; Wang, Zhao-Xi; Xie, Haomiao; Li, Ming-Xing; Woods, Toby J.; Dunbar, Kim R. A cobalt(ii) spin-crossover compound with partially charged TCNQ radicals and an anomalous conducting behavior Chem. Sci., 2016, 7, 1569 |
1542325 | CIF | C68 H37 Co N19 | P n a 21 | 18.969; 8.681; 33.397 90; 90; 90 | 5499 | Zhang, Xuan; Wang, Zhao-Xi; Xie, Haomiao; Li, Ming-Xing; Woods, Toby J.; Dunbar, Kim R. A cobalt(ii) spin-crossover compound with partially charged TCNQ radicals and an anomalous conducting behavior Chem. Sci., 2016, 7, 1569 |
1542326 | CIF | C68 H37 Co N19 | P n a 21 | 19.2853; 8.727; 33.589 90; 90; 90 | 5653.1 | Zhang, Xuan; Wang, Zhao-Xi; Xie, Haomiao; Li, Ming-Xing; Woods, Toby J.; Dunbar, Kim R. A cobalt(ii) spin-crossover compound with partially charged TCNQ radicals and an anomalous conducting behavior Chem. Sci., 2016, 7, 1569 |
1542327 | CIF | C68 H37 Co N19 | P n a 21 | 18.967; 8.6864; 33.532 90; 90; 90 | 5524.6 | Zhang, Xuan; Wang, Zhao-Xi; Xie, Haomiao; Li, Ming-Xing; Woods, Toby J.; Dunbar, Kim R. A cobalt(ii) spin-crossover compound with partially charged TCNQ radicals and an anomalous conducting behavior Chem. Sci., 2016, 7, 1569 |
1542328 | CIF | C68 H37 Co N19 | P n a 21 | 19.074; 8.705; 33.611 90; 90; 90 | 5581 | Zhang, Xuan; Wang, Zhao-Xi; Xie, Haomiao; Li, Ming-Xing; Woods, Toby J.; Dunbar, Kim R. A cobalt(ii) spin-crossover compound with partially charged TCNQ radicals and an anomalous conducting behavior Chem. Sci., 2016, 7, 1569 |
1542373 | CIF | C24 H18 N2 O3 | P n a 21 | 10.8282; 8.7931; 19.9988 90; 90; 90 | 1904.15 | Thikekar, Tushar Ulhas; Selvaraju, Manikandan; Sun, Chung-Ming Skeletally Diverse Synthesis of Indole-Fused Diazocine and Diazepine Frameworks by One-Pot, Two-Component Cascade Reaction. Organic letters, 2016, 18, 316-319 |
1542396 | CIF | C21 H16 O3 | P n a 21 | 8.233; 5.5792; 34.637 90; 90; 90 | 1591 | Laha, Radha M.; Khamarui, Saikat; Manna, Saikat K.; Maiti, Dilip K. In Situ Generated Ag(II)-Catalyzed Selective Oxo-Esterification of Alkyne with Alcohol to α-Ketoester: Photophysical Study. Organic letters, 2016, 18, 144-147 |
1542519 | CIF HKL Paper | C8 H4 Br N O2 | P n a 21 | 25.1411; 5.6851; 5.1593 90; 90; 90 | 737.42 | Gurung, Sita; Golen, James A.; Manke, David R. 5-Bromo-1<i>H</i>-indole-2,3-dione IUCrData, 2016, 1, x160177 |
1542643 | CIF | C24 H21 B F2 N2 | P n a 21 | 16.262; 8.2789; 15.194 90; 90; 90 | 2045.6 | Zhou, Xin; Wu, Qinghua; Yu, Yang; Yu, Changjiang; Hao, Erhong; Wei, Yun; Mu, Xiaolong; Jiao, Lijuan Metal-Free Direct α-Selective Arylation of Boron Dipyrromethenes via Base-Mediated C-H Functionalization. Organic letters, 2016, 18, 736-739 |
1542644 | CIF | C25 H23 B F2 N2 O | P n a 21 | 17.9538; 8.2467; 14.4494 90; 90; 90 | 2139.4 | Zhou, Xin; Wu, Qinghua; Yu, Yang; Yu, Changjiang; Hao, Erhong; Wei, Yun; Mu, Xiaolong; Jiao, Lijuan Metal-Free Direct α-Selective Arylation of Boron Dipyrromethenes via Base-Mediated C-H Functionalization. Organic letters, 2016, 18, 736-739 |
1542730 | CIF | C22 H18 | P n a 21 | 22.283; 10.1485; 6.7864 90; 90; 90 | 1534.7 | Chen, Gen-Qiang; Fang, Wei; Wei, Yin; Tang, Xiang-Ying; Shi, Min Divergent reaction pathways in gold-catalyzed cycloisomerization of 1,5-enynes containing a cyclopropane ring: dramatic ortho substituent and temperature effects Chem. Sci., 2016, 7, 4318 |
1542986 | CIF | C342 H428 Cd24 Cl7 N24 Nd8 O128 | P n a 21 | 54.734; 27.619; 35.243 90; 90; 90 | 53277 | Yang, Xiaoping; Wang, Shiqing; King, Tyler L.; Kerr, Christopher J.; Blanchet, Clement; Svergun, Dmitri; Pal, Robert; Beeby, Andrew; Vadivelu, Jamuna; Brown, Katherine A.; Jones, Richard A.; Zhang, Lijie; Huang, Shaoming Anisotropic lanthanide-based nano-clusters for imaging applications. Faraday discussions, 2016, 191, 465 |
1542987 | CIF | C342 H428 Cd24 Cl7 N24 O128 Tb8 | P n a 21 | 54.106; 27.127; 34.876 90; 90; 90 | 51189 | Yang, Xiaoping; Wang, Shiqing; King, Tyler L.; Kerr, Christopher J.; Blanchet, Clement; Svergun, Dmitri; Pal, Robert; Beeby, Andrew; Vadivelu, Jamuna; Brown, Katherine A.; Jones, Richard A.; Zhang, Lijie; Huang, Shaoming Anisotropic lanthanide-based nano-clusters for imaging applications. Faraday discussions, 2016, 191, 465 |
1543017 | CIF | C24 H7 B F15 N | P n a 21 | 13.7574; 8.8592; 18.0333 90; 90; 90 | 2197.89 | Zhang, Zhenbei; Miao, Chengxia; Xia, Chungu; Sun, Wei Synergistic Acid-Catalyzed Synthesis of N-Aryl-Substituted Azacycles from Anilines and Cyclic Ethers. Organic letters, 2016, 18, 1522-1525 |
1543038 | CIF HKL Paper | C27 H19 Cl N2 O | P n a 21 | 14.824; 8.2946; 16.924 90; 90; 90 | 2081 | Raja, Rajamani; Kandhasamy, Subramani; Narayanan, Uma Maheswari; Perumal, Paramasivam T.; Dhanapal, Ramu 1-[6-Chloro-2-(phenanthren-9-yl)quinolin-4-yl]pyrrolidin-2-one IUCrData, 2016, 1, x160529 |
1543044 | CIF | C50 H39 Cl10 N7 O8 Ru | P n a 21 | 16.7707; 12.8886; 24.1907 90; 90; 90 | 5228.8 | Zhu, Ben-Zhan; Chao, Xi-Juan; Huang, Chun-Hua; Li, Yan Delivering the cell-impermeable DNA ‘light-switching’ Ru(ii) complexes preferentially into live-cell nucleus via an unprecedented ion-pairing method Chem. Sci., 2016, 7, 4016 |
1543107 | CIF | C3 H8 N2 O6 Zn | P n a 21 | 8.6706; 7.72008; 11.4872 90; 90; 90 | 768.93 | Kieslich, Gregor; Kumagai, Shohei; Forse, Alexander C.; Sun, Shijing; Henke, Sebastian; Yamashita, Masahiro; Grey, Clare P.; Cheetham, Anthony K. Tuneable mechanical and dynamical properties in the ferroelectric perovskite solid solution [NH3NH2]1−x[NH3OH]xZn(HCOO)3 Chem. Sci., 2016, 7, 5108 |
1543108 | CIF | C3 H7.5 N1.5 O6.5 Zn | P n a 21 | 8.61779; 7.73073; 11.50052 90; 90; 90 | 766.185 | Kieslich, Gregor; Kumagai, Shohei; Forse, Alexander C.; Sun, Shijing; Henke, Sebastian; Yamashita, Masahiro; Grey, Clare P.; Cheetham, Anthony K. Tuneable mechanical and dynamical properties in the ferroelectric perovskite solid solution [NH3NH2]1−x[NH3OH]xZn(HCOO)3 Chem. Sci., 2016, 7, 5108 |
1543192 | CIF | C28 H20 O2 | P n a 21 | 20.259; 10.585; 9.94 90; 90; 90 | 2131.55 | Xu, Bingjia; Li, Wenlang; He, Jiajun; Wu, Sikai; Zhu, Qiangzhong; Yang, Zhiyong; Wu, Yuan-Chun; Zhang, Yi; Jin, Chongjun; Lu, Po-Yen; Chi, Zhenguo; Liu, Siwei; Xu, Jiarui; Bryce, Martin R. Achieving very bright mechanoluminescence from purely organic luminophores with aggregation-induced emission by crystal design Chem. Sci., 2016, 7, 5307 |
1543455 | CIF HKL Paper | C11 H19 N3 O3 | P n a 21 | 18.2964; 7.1388; 10.3574 90; 90; 90 | 1352.82 | Sivakumar, P.; Mani, A.; Sudhahar, S.; Israel, S.; Chakkaravarthi, G. Piperazin-1-ium 4-aminobenzoate monohydrate IUCrData, 2016, 1, x160819 |
1543515 | CIF | C20 H10 F4 I N3 | P n a 21 | 7.1624; 7.4352; 33.215 90; 90; 90 | 1768.8 | Maugeri, Leonardo; Asencio-Hernández, Julia; Lébl, Tomáš; Cordes, David B.; Slawin, Alexandra M. Z.; Delsuc, Marc-André; Philp, Douglas Neutral iodotriazoles as scaffolds for stable halogen-bonded assemblies in solution Chem. Sci., 2016, 7, 6422 |
1543619 | CIF HKL Paper | C9 H10 O3 | P n a 21 | 11.374; 14.363; 5.05 90; 90; 90 | 825 | de Ronde, Erik; Brugman, Sander J.T.; Koning, Niels; Tinnemans, Paul; Vlieg, Elias 3,4-Dimethoxybenzaldehyde IUCrData, 2016, 1, x161008 |
1543723 | CIF | C23 H24 Br N O | P n a 21 | 11.8036; 21.3495; 7.9601 90; 90; 90 | 2006 | Li, Yang; Pan, Gao-Hui; Hu, Ming; Liu, Bang; Song, Ren-Jie; Li, Jin-Heng Intermolecular Oxidative Decarbonylative [2+2+2] Carbocyclization of N-(2-Ethynylaryl)acrylamides with Tertiary Alkyl Aldehydes involving C(sp3)-H Functionalization Chem. Sci., 2016 |
1543805 | CIF | C30 H23 N O4 S | P n a 21 | 18.3425; 10.4967; 52.3489 90; 90; 90 | 10079 | Prabagar, B.; Nayak, Sanatan; Prasad, Rangu; Sahoo, Akhila K. Dimethyl Sulfoxide and N-Iodosuccinimide Promoted 5-exo-dig Oxidative Cyclization of Yne-Tethered Ynamide: Access to Pyrrolidones and Spiro-pyrrolidones. Organic letters, 2016, 18, 3066-3069 |
1543806 | CIF | C23 H17 N O2 | P n a 21 | 11.9577; 33.256; 8.9182 90; 90; 90 | 3546.5 | Prabagar, B.; Nayak, Sanatan; Prasad, Rangu; Sahoo, Akhila K. Dimethyl Sulfoxide and N-Iodosuccinimide Promoted 5-exo-dig Oxidative Cyclization of Yne-Tethered Ynamide: Access to Pyrrolidones and Spiro-pyrrolidones. Organic letters, 2016, 18, 3066-3069 |
1543810 | CIF | C16 H11 N O2 | P n a 21 | 17.8024; 7.7552; 17.7401 90; 90; 90 | 2449.2 | Chen, Xiaopei; Cui, Xiuling; Wu, Yangjie "One-Pot" Approach to 8-Acylated 2-Quinolinones via Palladium-Catalyzed Regioselective Acylation of Quinoline N-Oxides. Organic letters, 2016, 18, 2411-2414 |
1543811 | CIF | C16 H11 N O2 | P n a 21 | 7.0519; 23.5069; 7.5339 90; 90; 90 | 1248.88 | Chen, Xiaopei; Cui, Xiuling; Wu, Yangjie "One-Pot" Approach to 8-Acylated 2-Quinolinones via Palladium-Catalyzed Regioselective Acylation of Quinoline N-Oxides. Organic letters, 2016, 18, 2411-2414 |
1543817 | CIF | C21 H22 Br N O3 S | P n a 21 | 23.544; 6.96; 24.234 90; 90; 90 | 3971.1 | Yeh, Ming-Chang P; Shiue, Yuan-Shin; Lin, Hsin-Hui; Yu, Tzu-Yu; Hu, Ting-Chia; Hong, Jia-Jyun Iron(II) Halide Promoted Cyclization of Cyclic 2-Enynamides: Stereoselective Synthesis of Halogenated Bicyclic γ-Lactams. Organic letters, 2016, 18, 2407-2410 |
1543875 | CIF HKL Paper | C12 H9 Br F N O2 S | P n a 21 | 19.7608; 12.4156; 5.0776 90; 90; 90 | 1245.75 | Rodrigues, Vinola Z.; Suchetan, P. A.; Saritha, L.; Lokanath, N. K.; Naveen, S. 4-Bromo-<i>N</i>-(4-fluorophenyl)benzenesulfonamide IUCrData, 2016, 1, x161256 |
1544062 | CIF HKL Paper | C14 H16 N2 O2 | P n a 21 | 16.7541; 11.0261; 7.2064 90; 90; 90 | 1331.3 | Sivakumar, P.; Anzline, C.; Israel, S.; Chakkaravarthi, G. 2-Amino-4-methylpyridinium 4-methylbenzoate IUCrData, 2016, 1, x161411 |
1544274 | CIF HKL Paper | C18 H16 Cl F2 N O | P n a 21 | 6.2844; 11.7141; 21.6006 90; 90; 90 | 1590.15 | Arulraj, R.; Sivakumar, S.; Thiruvalluvar, A.; Kaur, Manpreet; Jasinski, Jerry P. 3-Chloro-<i>r</i>-2,<i>c</i>-6-bis(4-fluorophenyl)-3-methylpiperidin-4-one IUCrData, 2016, 1, x161580 |
1544302 | CIF | C20 H12 N2 | P n a 21 | 17.7436; 10.851; 7.5217 90; 90; 90 | 1448.2 | Bajpai, Alankriti; Scott, Hayley S.; Pham, Tony; Chen, Kai-Jie; Space, Brian; Lusi, Matteo; Perry, Miranda L.; Zaworotko, Michael J. Towards an understanding of the propensity for crystalline hydrate formation by molecular compounds IUCrJ, 2016, 3 |
1544305 | CIF | C20 H20 N2 O0 | P n a 21 | 21.105; 6.5848; 11.241 90; 90; 90 | 1562.2 | Bajpai, Alankriti; Scott, Hayley S.; Pham, Tony; Chen, Kai-Jie; Space, Brian; Lusi, Matteo; Perry, Miranda L.; Zaworotko, Michael J. Towards an understanding of the propensity for crystalline hydrate formation by molecular compounds IUCrJ, 2016, 3 |
1544400 | CIF HKL Paper | C40 H42 N2 O11 | P n a 21 | 14.3387; 25.331; 9.8536 90; 90; 90 | 3579 | Kim, Jong Sik; Lee, Jai Young; Lee, So Yeon; Lee, Tae Yeon; Sim, Wonbo 5,31-Diaza-2,8,15,18,21,28,34,41,44,47-decaoxaheptacyclo[46.4.0.0^4,32^.0^6,30^.0^9,14^.0^22,27^.0^35,40^]dopentaconta-1(48),4,6(30),9(14),10,12,22(27),23,25,31,35(40),36,38,49,51-pentadecaene monohydrate IUCrData, 2016, 1, x161698 |
1544401 | CIF HKL Paper | C17 H19 N3 O3 | P n a 21 | 8.9099; 24.55; 7.2359 90; 90; 90 | 1582.8 | El-Khatatneh, Nasseem; Chandra; Shamala, D.; Shivashankar, K.; Mahendra, M. 6-<i>tert</i>-Butyl-4-[(4-hydroxymethyl-2<i>H</i>-1,2,3-triazol-2-yl)methyl]-2<i>H</i>-chromen-2-one IUCrData, 2016, 1, x161618 |
1544453 | CIF | Co0.4 Cu1.6 O5 Sc2 | P n a 21 | 10.427; 3.2112; 12.069 90; 90; 90 | 404.11 | Imanaka, N.; Shimizu, T.; Saito, F.; Kobayashi, Y.; Adachi, G.; Liu, G.; Greedan, Edward, J. Structure and magnetic properties of quasi-one dimensional cobalt-doped scandium cuprate compounds Journal of the Ceramic Society of Japan, 1995, 103, 330-334 |
1544528 | CIF HKL Paper | C2 H8 Cl2 N4 Pb S2 | P n a 21 | 21.1951; 4.028; 11.9433 90; 90; 90 | 1019.65 | Zouihri, Hafid; Yamni, Khalid; Messouss, Youssef; Tijani, Najib; Messaoudi, Lahcen Redetermination of <i>catena</i>-poly[[chloridolead(II)]-μ~2~-chlorido-di-μ~2~-thiourea-κ^4^<i>S</i>:<i>S</i>] at 100K IUCrData, 2016, 1, x161745 |
1544709 | CIF HKL | C12 H14 N4 O2 | P n a 21 | 9.0504; 9.0612; 14.3565 90; 90; 90 | 1177.34 | Bouayyadi, Abdellatif; Moussaif, Ahmed; Mesfioui, Abdelhalim; Mzibri, Mohammed; Saadi, Mohamed; El Ammari, Lahcen 3-[2-(2-Amino-1<i>H</i>-benzo[<i>d</i>]imidazol-1-yl)ethyl]-1,3-oxazolidin-2-one IUCrData, 2016, 1, x161895 |
1544758 | CIF | C39 H51 Cl Fe N3 P3 Si | P n a 21 | 38.962; 11.0406; 18.1487 90; 90; 90 | 7806.9 | Creutz, Sidney E.; Peters, Jonas C. Exploring secondary-sphere interactions in Fe-N x H y complexes relevant to N2 fixation. Chemical science, 2017, 8, 2321-2328 |
1544870 | CIF | Ca1.55 O4 Si Sr0.45 | P n a 21 | 20.522; 9.339; 5.558 90; 90; 90 | 1065.2 | Itoh, H.; Nishi, F.; Kuribayashi, T.; Kudoh, Y. Orientational ordering of three SiO4 tetrahedra in alpha'L-Ca1.5Sr0.5SiO4 that satisfies bond-valence requirements and avoids O-O replusion Journal of Mineralogical and Petrological Sciences, 2009, 104, 234-240 |
1544942 | CIF | C30 H25 Cl N2 O3 | P n a 21 | 20.2861; 24.7581; 31.1511 90; 90; 90 | 15645.5 | Zhao, Hong-Wu; Liu, Yue-Yang; Zhao, Yu-Di; Pang, Hai-Liang; Chen, Xiao-Qin; Song, Xiu-Qing; Tian, Ting; Li, Bo; Yang, Zhao; Du, Juan; Feng, Ning-Ning [3 + 2] Cycloaddition of Oxazol-5-(4H)-ones with Nitrones for Diastereoselective Synthesis of Isoxazolidin-5-ones. Organic letters, 2016 |
1545044 | CIF HKL Paper | C11 H8 F N O2 | P n a 21 | 31.531; 4.2752; 14.108 90; 90; 90 | 1901.8 | Qachchachi, Fatim-Zahrae; Mague, Joel T.; Kandri Rodi, Youssef; Haoudi, Amal; Ouzidan, Younes; Essassi, El Mokhtar 5-Fluoro-1-(prop-2-en-1-yl)-2,3-dihydro-1<i>H</i>-indole-2,3-dione IUCrData, 2017, 2, x170028 |
1545200 | CIF | C10 H7 Cl O3 | P n a 21 | 16.6863; 4.1596; 12.8685 90; 90; 90 | 893.18 | Verastegui-Omaña, Brisa; Rebollar-Ramos, Daniela; Pérez-Vásquez, Araceli; Martínez, Ana Laura; Madariaga-Mazón, Abraham; Flores-Bocanegra, Laura; Mata, Rachel α-Glucosidase Inhibitors from Malbranchea flavorosea. Journal of natural products, 2017, 80, 190-195 |
1545230 | CIF | C17 H14 F N O | P n a 21 | 11.204; 16.267; 7.421 90; 90; 90 | 1352.5 | Tiwari, Virendra Kumar; Kamal, Neha; Kapur, Manmohan One Substrate, Two Modes of C-H Functionalization: A Metal-Controlled Site-Selectivity Switch in C-H Arylation Reactions. Organic letters, 2017, 19, 262-265 |
1545281 | CIF | C27 H40 F2 N P2 Rh | P n a 21 | 16.693; 16.565; 9.888 90; 90; 90 | 2734.2 | Pell, Christopher J.; Zhu, Yanjun; Huacuja, Rafael; Herbert, David E.; Hughes, Russell P.; Ozerov, Oleg V. Fluorocarbene, fluoroolefin, and fluorocarbyne complexes of Rh Chem. Sci., 2017, 8, 3178 |
1545282 | CIF | C28 H41 B11 Cl11 F N P2 Rh | P n a 21 | 20.427; 19.756; 11.606 90; 90; 90 | 4684 | Pell, Christopher J.; Zhu, Yanjun; Huacuja, Rafael; Herbert, David E.; Hughes, Russell P.; Ozerov, Oleg V. Fluorocarbene, fluoroolefin, and fluorocarbyne complexes of Rh Chem. Sci., 2017, 8, 3178 |
1545402 | CIF | C16 H17 N3 O8 | P n a 21 | 20.8281; 4.7751; 16.9177 90; 90; 90 | 1682.57 | Chan, Chieh-Kai; Tsai, Yu-Lin; Chang, Meng-Yang Construction of Nitrated Benzo[3.3.1]bicyclic Acetal/Ketal Core via Nitration of o-Carbonyl Allylbenzenes. Organic letters, 2017, 19, 1358-1361 |
1545526 | CIF | C32 H24 N2 | P n a 21 | 12.6825; 14.4458; 13.1365 90; 90; 90 | 2406.72 | Kim, Og Soon; Jang, Jin Hyeok; Kim, Hyun Tae; Han, Su Jin; Tsui, Gavin Chit; Joo, Jung Min Synthesis of Fluorescent Indazoles by Palladium-Catalyzed Benzannulation of Pyrazoles with Alkynes. Organic letters, 2017, 19, 1450-1453 |
1545694 | CIF | C24 H23 N O | P n a 21 | 11.5218; 9.9089; 16.3736 90; 90; 90 | 1869.35 | Dhungana, Roshan K.; Shrestha, Bijay; Thapa-Magar, Rajani; Basnet, Prakash; Giri, Ramesh Pd-Catalyzed Regioselective 1,2-Dicarbofunctionalization of Unactivated Olefins by a Heck Reaction/Enolate Cyclization Cascade. Organic letters, 2017, 19, 2154-2157 |
1545772 | CIF | C19 H38 Fe2 N6 O19 P2 | P n a 21 | 21.3916; 9.4099; 16.1292 90; 90; 90 | 3246.69 | Du, Kang; Waters, Emily Alex; Harris, David David Ratiometric Quantitation of Redox Status with a Molecular Fe2 Magnetic Resonance Probe Chem. Sci., 2017 |
1545968 | CIF | C18 H19 Br F3 N O2 S | P n a 21 | 7.1072; 23.128; 10.8794 90; 90; 90 | 1788.3 | Cendón, Borja; Casanova, Noelia; Comanescu, Cezar; García-Fandiño, Rebeca; Seoane, Andrés; Gulías, Moisés; Mascareñas, José L Palladium-Catalyzed Formal (5 + 2) Annulation between ortho-Alkenylanilides and Allenes. Organic letters, 2017, 19, 1674-1677 |
1546026 | CIF | Ca2 O4 Si | P n a 21 | 20.5266; 9.4963; 5.5897 90; 90; 90 | 1089.58 | Mumme, W.G.; Cranswick, L.; Chakoumakos, B. Rietveld crystal structure refinement from high temperature neutron powder diffraction data for the polymorphs of dicalcium silicate Neues Jahrbuch fuer Mineralogie. Abhandlungen (Band-Nr) (1950-), 1996, 170, 171-188 |
1546177 | CIF | C30 H56 Al N2 O3 Si3 Ti | P n a 21 | 12.528; 18.992; 15.352 90; 90; 90 | 3653 | Brown, Alexandra C.; Altman, Alison B.; Lohrey, Trevor D.; Hohloch, Stephan; Arnold, John Hydride oxidation from a titanium‒aluminum bimetallic complex: insertion, thermal and electrochemical reactivity Chem. Sci., 2017 |
1546216 | CIF | C12 H8 F3 N O3 | P n a 21 | 18.3137; 12.486; 4.8092 90; 90; 90 | 1099.7 | Lv, Ningning; Chen, Zhengkai; Liu, Yue; Liu, Zhanxiang; Zhang, Yuhong Synthesis of Functionalized Indenones via Rh-Catalyzed C-H Activation Cascade Reaction. Organic letters, 2017, 19, 2588-2591 |
1546228 | CIF | C29 H30 Cl2 N2 O3 S | P n a 21 | 20.5163; 16.682; 7.9278 90; 90; 90 | 2713.3 | Saputra, Mirza A.; Dange, Nitin S.; Cleveland, Alexander H.; Malone, Joshua A.; Fronczek, Frank R.; Kartika, Rendy Regioselective Functionalization of Enamides at the α-Carbon via Unsymmetrical 2-Amidoallyl Cations. Organic letters, 2017, 19, 2414-2417 |
1546362 | CIF | C9 H12 O2 | P n a 21 | 11.629; 12.235; 5.656 90; 90; 90 | 804.7 | Xie, Changmin; Luo, Jisheng; Zhang, Yan; Zhu, Lili; Hong, Ran A Chiral Pentenolide-Based Unified Strategy toward Dihydrocorynantheal, Dihydrocorynantheol, Protoemetine, Protoemetinol, and Yohimbane. Organic letters, 2017, 19, 3592-3595 |
1546585 | CIF | C58 H52 Ag Au Cl2 N4 O4 | P n a 21 | 22.04; 16.674; 14.2441 90; 90; 90 | 5234.6 | McCall, Rebecca; Miles, Meredith; Lascuna, Paul; Burney, Briana; Patel, Zarana; Sidoran, Kevin; Sittaramane, Vinoth; Kocerha, Jannet; Grossie, David; Sessler, Jonathan L.; Arumugam, Kuppuswamy; Arambula, Jonathan Dual Targeting of the Cancer Antioxidant Network with Naphthoquinone Fused Gold(I) N-heterocyclic Carbene Complexes Chem. Sci., 2017 |
1546591 | CIF | C29 H35 N3 O6 | P n a 21 | 17.429; 12.471; 13.016 90; 90; 90 | 2829 | Singh, Ravi P.; Das, Jayanta; Yousufuddin, Muhammed; Gout, Delphine; Lovely, Carl J. Tandem Oxidative Dearomatizing Spirocyclizations of Propargyl Guanidines and Ureas. Organic letters, 2017, 19, 4110-4113 |
1546646 | CIF HKL Paper | C15 H20 Br N3 O2 | P n a 21 | 22.569; 5.1097; 13.497 90; 90; 90 | 1556.5 | Hjouji, Mohammed Yassin; Mague, Joel T.; Kandri Rodi, Youssef; Ouzidan, Younes; Ouazzani Chahdi, Fouad; Essassi, El Mokhtar 7-Bromo-1,4-dibutyl-1,2,3,4-tetrahydropyrido[2,3-<i>b</i>]pyrazine-2,3-dione IUCrData, 2017, 2, x170984 |
1546651 | CIF HKL Paper | C17 H17 N3 O | P n a 21 | 12.035; 24.5052; 4.9909 90; 90; 90 | 1471.92 | Rayni, Ibtissam; El Bakri, Youness; Sebhaoui, Jihad; El Bourakadi, Khadija; Essassi, El Mokhtar; Mague, Joel T. 2-(1-Hexyl-2-oxo-2,3-dihydro-1<i>H</i>-indol-3-ylidene)propanedinitrile IUCrData, 2017, 2, x170706 |
1546670 | CIF HKL Paper | C13 H12 N6 O2 | P n a 21 | 20.333; 14.2764; 4.5089 90; 90; 90 | 1308.85 | Sahbi, Azzeddine; Mague, Joel T.; Ben-Tama, Abdeslem; El Hadrami, El Mestafa; Gaamoussi, Issam; Ouzidan, Younes 4-[(1<i>H</i>-Imidazol-1-yl)methyl]-1-(4-nitrobenzyl)-1<i>H</i>-1,2,3-triazole IUCrData, 2017, 2, x170515 |
1546728 | CIF HKL Paper | C9 H21 N O2 | P n a 21 | 14.152; 9.8983; 15.9939 90; 90; 90 | 2240.4 | Lutter, Michael; Gock, Vinusuya; Jurkschat, Klaus The amino alcohol MeN(CH~2~CMe~2~OH)~2~ IUCrData, 2017, 2, x170799 |
1546842 | CIF | C24 H20 N2 O6 | P n a 21 | 28.9068; 7.9025; 8.9889 90; 90; 90 | 2053.39 | Preindl, Johannes; Chakrabarty, Shyamal; Waser, Jérôme Dearomatization of electron poor six-membered N-heterocycles through [3 + 2] annulation with aminocyclopropanes Chemical Science, 2017, 8, 7112-7118 |
1546881 | CIF | Ag3 I3 Mo2 O12 | P n a 21 | 8.0072; 21.2678; 7.3241 90; 90; 90 | 1247.26 | Meng, Chang-Yu; Zhang, Pei; Wang, Rong-Fang; Geng, Lei Ag <sub>3</sub> I[(MoO <sub>3</sub> ) <sub>2</sub> (IO <sub>3</sub> ) <sub>2</sub> ]: a new polar material synthesized from the structural modulation of molybdenyl iodate architectures by polarizable cation (Ag <sup>+</sup> ) and anion (I <sup>−</sup> ) Dalton Transactions, 2017, 46, 12320-12327 |
1546882 | CIF | B2 Cs Na4 O13 P3 | P n a 21 | 24.5034; 6.7673; 14.7803 90; 90; 90 | 2450.9 | Wu, Chao; Li, Longhua; Yang, Gang; Song, Junling; Yan, Bing; Humphrey, Mark G.; Zhang, Long; Shao, Jianda; Zhang, Chi Low-temperature-flux syntheses of ultraviolet-transparent borophosphates Na <sub>4</sub> MB <sub>2</sub> P <sub>3</sub> O <sub>13</sub> (M = Rb, Cs) exhibiting a second-harmonic generation response Dalton Transactions, 2017, 46, 12605-12611 |
1546883 | CIF | B2 Na4 O13 P3 Rb | P n a 21 | 24.0348; 6.7464; 14.9206 90; 90; 90 | 2419.35 | Wu, Chao; Li, Longhua; Yang, Gang; Song, Junling; Yan, Bing; Humphrey, Mark G.; Zhang, Long; Shao, Jianda; Zhang, Chi Low-temperature-flux syntheses of ultraviolet-transparent borophosphates Na <sub>4</sub> MB <sub>2</sub> P <sub>3</sub> O <sub>13</sub> (M = Rb, Cs) exhibiting a second-harmonic generation response Dalton Transactions, 2017, 46, 12605-12611 |
1547118 | CIF | C25 H21 N2 O3 | P n a 21 | 9.6628; 18.241; 11.829 90; 90; 90 | 2085 | Singh, Ravi P.; Das, Jayanta; Yousufuddin, Muhammed; Gout, Delphine; Lovely, Carl J. Tandem Oxidative Dearomatizing Spirocyclizations of Propargyl Guanidines and Ureas. Organic letters, 2017, 19, 4110-4113 |
1547143 | CIF | F5 H6 N2 Sb | P n a 21 | 5.627; 7.034; 12.855 90; 90; 90 | 508.8 | Barbes, H.; Mascherpa, G.; Fourcade, R.; Ducourant, B. Correlations conductivite protonique-structures dans le difluorure et le pentafluoroantimonate III d hydrazinium: structure cristalline de N2H6SbF5 Journal of Solid State Chemistry, 1985, 60, 95-100 |
1547180 | CIF | C3 H6 Cl4 N3 O2 P3 | P n a 21 | 13.3686; 10.4704; 8.7799 90; 90; 90 | 1228.96 | Simon J Coles; David B Davies; Michael B Hursthouse; Susanne L Huth; Adem Kilic; Mark E Light; Marianne Odlyha; John S Rutherford; Robert A Shaw; Aylin Uslu Characterisation of temperature-dependent phase transitions in 2,2-trimethylenedioxy- 4,4,6,6-tetrachlorocyclotriphosphazene, N3P3Cl4[O(CH2)3O] Chemistry Central Journal, 2007, 1, 20 |
1547181 | CIF | C3 H6 Cl4 N3 O2 P3 | P n a 21 | 13.4804; 10.6442; 8.8479 90; 90; 90 | 1269.6 | Simon J Coles; David B Davies; Michael B Hursthouse; Susanne L Huth; Adem Kilic; Mark E Light; Marianne Odlyha; John S Rutherford; Robert A Shaw; Aylin Uslu Characterisation of temperature-dependent phase transitions in 2,2-trimethylenedioxy- 4,4,6,6-tetrachlorocyclotriphosphazene, N3P3Cl4[O(CH2)3O] Chemistry Central Journal, 2007, 1, 20 |
1547295 | CIF | C12 H16 N2 O2 | P n a 21 | 11.9025; 7.4111; 13.2657 90; 90; 90 | 1170.18 | Hao, Feiyue; Asahara, Haruyasu; Nishiwaki, Nagatoshi Direct Aziridination of Nitroalkenes Affording N-Alkyl-C-nitroaziridines and the Subsequent Lewis Acid Mediated Isomerization to β-Nitroenamines. Organic letters, 2017, 19, 5442-5445 |
1547408 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4393; 8.1764; 21.7395 90; 90; 90 | 2566.6 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547409 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4687; 8.1829; 21.8084 90; 90; 90 | 2582 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547410 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4829; 8.1938; 21.8441 90; 90; 90 | 2592.24 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547411 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4899; 8.2086; 21.9106 90; 90; 90 | 2606.09 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547412 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4902; 8.2249; 22.0106 90; 90; 90 | 2623.2 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547413 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4588; 8.18; 21.7664 90; 90; 90 | 2574.38 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547414 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4597; 8.1802; 21.7812 90; 90; 90 | 2576.35 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547415 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4638; 8.1835; 21.7953 90; 90; 90 | 2579.79 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547416 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4666; 8.1868; 21.8103 90; 90; 90 | 2583.11 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547417 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4701; 8.1889; 21.8216 90; 90; 90 | 2585.73 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547418 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4734; 8.1921; 21.8397 90; 90; 90 | 2589.48 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547419 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4763; 8.1946; 21.8522 90; 90; 90 | 2592.27 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547420 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4795; 8.1974; 21.8693 90; 90; 90 | 2595.76 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547421 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4814; 8.1993; 21.8844 90; 90; 90 | 2598.5 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547422 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4852; 8.202; 21.9002 90; 90; 90 | 2601.91 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547423 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4884; 8.2048; 21.9167 90; 90; 90 | 2605.34 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547424 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4914; 8.2069; 21.9332 90; 90; 90 | 2608.5 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547425 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.495; 8.2094; 21.9489 90; 90; 90 | 2611.81 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547426 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.4973; 8.2118; 21.9658 90; 90; 90 | 2615 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547427 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.5008; 8.2141; 21.9821 90; 90; 90 | 2618.31 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547428 | CIF | C11 H12 N4 O2 S | P n a 21 | 14.504; 8.2162; 21.9984 90; 90; 90 | 2621.5 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547506 | CIF | C34 H33 N O7 S | P n a 21 | 21.688; 9.136; 30.698 90; 90; 90 | 6082.5 | Chen, Junlong; Huang, You Phosphine-Catalyzed Sequential [4 + 3] Domino Annulation/Allylic Alkylation Reaction of MBH Carbonates: Efficient Construction of Seven-Membered Heterocycles. Organic letters, 2017, 19, 5609-5612 |
1547513 | CIF | C26 H44 F6 N4 O6 S2 | P n a 21 | 23.095; 13.2861; 10.6916 90; 90; 90 | 3280.6 | Mandal, Debdeep; Dolai, Ramapada; Chrysochos, Nicolas; Kalita, Pankaj; Kumar, Ravi; Dhara, Debabrata; Maiti, Avijit; Narayanan, Ramakirushnan Suriya; Rajaraman, Gopalan; Schulzke, Carola; Chandrasekhar, Vadapalli; Jana, Anukul Stepwise Reversible Oxidation of N-Peralkyl-Substituted NHC-CAAC Derived Triazaalkenes: Isolation of Radical Cations and Dications. Organic letters, 2017, 19, 5605-5608 |
1547582 | CIF | C19 H19 Br N2 O | P n a 21 | 15.3885; 7.1222; 30.3 90; 90; 90 | 3320.9 | Zhao, Jie; Zhao, Xiao-Jing; Cao, Pei; Liu, Ji-Kai; Wu, Bin Polycyclic Azetidines and Pyrrolidines via Palladium-Catalyzed Intramolecular Amination of Unactivated C(sp3)-H Bonds. Organic letters, 2017, 19, 4880-4883 |
1547653 | CIF | C4 H14 Bi Br5 N2 | P n a 21 | 18.297; 10.234; 7.8231 90; 90; 90 | 1464.9 | Wang, Ya; Shi, Chao; Han, Xiang-Bin Mixed Bromine‒Chlorine Induced Great Dielectric and Second-Order Nonlinear Optical Properties Changes in Phase Transitions Compounds [H2mdap][BiBr5(1-x)Cl5x] (x = 0.00‒1.00) The Journal of Physical Chemistry C, 2017, 121, 23039 |
1547654 | CIF | C4 H14 Bi Br3.1 Cl1.9 N2 | P n a 21 | 18.16; 10.074; 7.6542 90; 90; 90 | 1400.3 | Wang, Ya; Shi, Chao; Han, Xiang-Bin Mixed Bromine‒Chlorine Induced Great Dielectric and Second-Order Nonlinear Optical Properties Changes in Phase Transitions Compounds [H2mdap][BiBr5(1-x)Cl5x] (x = 0.00‒1.00) The Journal of Physical Chemistry C, 2017, 121, 23039 |
1547655 | CIF | C4 H14 Bi Br1.8 Cl3.2 N2 | P n a 21 | 18.109; 9.998; 7.5855 90; 90; 90 | 1373.4 | Wang, Ya; Shi, Chao; Han, Xiang-Bin Mixed Bromine‒Chlorine Induced Great Dielectric and Second-Order Nonlinear Optical Properties Changes in Phase Transitions Compounds [H2mdap][BiBr5(1-x)Cl5x] (x = 0.00‒1.00) The Journal of Physical Chemistry C, 2017, 121, 23039 |
1547656 | CIF | C4 H14 Bi Br1.4 Cl3.6 N2 | P n a 21 | 18.12; 9.95; 7.5357 90; 90; 90 | 1358.6 | Wang, Ya; Shi, Chao; Han, Xiang-Bin Mixed Bromine‒Chlorine Induced Great Dielectric and Second-Order Nonlinear Optical Properties Changes in Phase Transitions Compounds [H2mdap][BiBr5(1-x)Cl5x] (x = 0.00‒1.00) The Journal of Physical Chemistry C, 2017, 121, 23039 |
1547657 | CIF | C4 H14 Bi Br1.1 Cl3.9 N2 | P n a 21 | 18.209; 9.975; 7.5491 90; 90; 90 | 1371.2 | Wang, Ya; Shi, Chao; Han, Xiang-Bin Mixed Bromine‒Chlorine Induced Great Dielectric and Second-Order Nonlinear Optical Properties Changes in Phase Transitions Compounds [H2mdap][BiBr5(1-x)Cl5x] (x = 0.00‒1.00) The Journal of Physical Chemistry C, 2017, 121, 23039 |
1547703 | CIF | C24 H25 Cl3 Ir N4 | P n a 21 | 21.597; 7.285; 16.615 90; 90; 90 | 2614.1 | Liang, Ran; Li, Shun; Wang, Rongzhou; Lu, Lei; Li, Feng N-Methylation of Amines with Methanol Catalyzed by a Cp*Ir Complex Bearing a Functional 2,2'-Bibenzimidazole Ligand. Organic letters, 2017, 19, 5790-5793 |
1547727 | CIF | C15 H24 Cl N O | P n a 21 | 21.142; 9.442; 14.826 90; 90; 90 | 2959.6 | Edwards, Peter M.; Schafer, Laurel L. In Situ Generation of a Regio- and Diastereoselective Hydroaminoalkylation Catalyst Using Commercially Available Starting Materials. Organic letters, 2017, 19, 5720-5723 |
1547897 | CIF | C20 H40 Cl2 F12 Mg2 N2 O16 S4 | P n a 21 | 24.817; 8.7512; 39.949 90; 90; 90 | 8676 | Salama, Michael; Shterenberg, Ivgeni; J.W. Shimon, Linda; Keinan-Adamsky, Keren; Afri, Michal; Gofer, Yosef; Aurbach, Doron Structural Analysis of Magnesium Chloride Complexes in Dimethoxyethane Solutions in the Context of Mg Batteries Research The Journal of Physical Chemistry C, 2017, 121, 24909 |
1547904 | CIF | C26 H15 O P | P n a 21 | 13.2917; 7.5342; 19.659 90; 90; 90 | 1968.7 | Rawe, Benjamin W.; Scott, Michael R.; Brown, Christopher M.; MacKenzie, Harvey K.; Gates, Derek P. Poly(p-phenylenediethynylene phosphine)s and Related π-Conjugated Phosphine–Diyne Polymers: Synthesis, Characterization and Photophysical Properties Macromolecules, 2017, 50, 8916 |
1547924 | CIF | C21 H19 N | P n a 21 | 13.5127; 9.4159; 25.6168 90; 90; 90 | 3259.3 | Lim, Ngiap-Kie; Weiss, Patrick; Li, Beryl X.; McCulley, Christina H.; Hare, Stephanie R.; Bensema, Bronwyn L.; Palazzo, Teresa A.; Tantillo, Dean J.; Zhang, Haiming; Gosselin, Francis Synthesis of Highly Stereodefined Tetrasubstituted Acyclic All-Carbon Olefins via a Syn-Elimination Approach. Organic letters, 2017, 19, 6212-6215 |
1548137 | CIF | C43 H64 B Cu Mo N11 O2 S | P n a 21 | 16.5; 27.26; 13.249 90; 90; 90 | 5959 | Gourlay, Craig; Nielsen, David John; Evans, David J.; White, Jonathan; Young, Charles Graham Models for Aerobic Carbon Monoxide Dehydrogenase: Synthesis, Characterization and Reactivity of Paramagnetic MoVO(μ-S)CuI Complexes Chemical Science, 2017 |
1548262 | CIF | C21 H20 B2 N4 O2 | P n a 21 | 15.071; 8.378; 14.966 90; 90; 90 | 1889.7 | Baolin Wang; Yongxin Li; Rakesh Ganguly; Hajime Hirao; Rei Kinjo Ambiphilic boron in 1,4,2,5-diazadiborinine Nature Communications, 2016, 7, 11871 |
1548445 | CIF | C45 H64 B2 N2 O3 | P n a 21 | 19.208; 13.253; 16.091 90; 90; 90 | 4096.2 | Katsuma, Yuhei; Asakawa, Hiroki; Yamashita, Makoto Reactivity of highly Lewis acidic diborane(4) towards pyridine and isocyanide: formation of boraalkene-pyridine complex and <i>ortho</i>-functionalized pyridine derivatives. Chemical science, 2018, 9, 1301-1310 |
1548459 | CIF | C106 H66 B4 F40 O2 P2 | P n a 21 | 23.2043; 30.9754; 14.803 90; 90; 90 | 10639.8 | Wang, Long; Dong, Shunxi; Daniliuc, Constantin G.; Liu, Lei; Grimme, Stefan; Knitsch, Robert; Eckert, Hellmut; Hansen, Michael Ryan; Kehr, Gerald; Erker, Gerhard Formation of macrocyclic ring systems by carbonylation of trifunctional P/B/B frustrated Lewis pairs. Chemical science, 2018, 9, 1544-1550 |
1548616 | CIF | C15 H21 Ga O6 | P n a 21 | 15.7074; 32.8408; 13.412 90; 90; 90 | 6918.5 | Li, Wenzhe; Zhang, Cuiling; Ma, Yunping; Liu, Chong; Fan, Jiandong; Mai, Yaohua; Schropp, Ruud E. I. In situ induced core/shell stabilized hybrid perovskites via gallium(iii) acetylacetonate intermediate towards highly efficient and stable solar cells Energy & Environmental Science, 2018, 11, 286 |
1548670 | CIF HKL Paper | C19 H16 N2 O2 | P n a 21 | 32.387; 9.8559; 5.0043 90; 90; 90 | 1597.4 | El-Hiti, Gamal A.; Mohamed, Hanan A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Hegazy, Amany S.; Kariuki, Benson M. Ethyl 1-phenyl-1,4-dihydroindeno[1,2-<i>c</i>]pyrazole-3-carboxylate IUCrData, 2018, 3, x171840 |
1548704 | CIF | C44 H44 Ag3 F17.96 N16 O2 P3 | P n a 21 | 12.6724; 16.1107; 27.71 90; 90; 90 | 5657.3 | Lindhorst, Anja C.; Kaspar, Manuel; Altmann, Philipp J.; Pöthig, Alexander; Kühn, Fritz E Synthesis, characterization and derivatization of hydroxyl-functionalized iron(ii) bis(NHC) complexes. Dalton transactions (Cambridge, England : 2003), 2018, 47, 1857-1867 |
1548715 | CIF | C44 H60 Cl Fe N4 O7 | P n a 21 | 23.085; 18.8929; 9.484 90; 90; 90 | 4136.4 | Ming Li; Allen G. Oliver; Teresa J. Neal; Charles E. Schulz; W. Robert Scheidt Effect of the Ruffled Porphyrin Ring on Electronic Structures: Structure and Characterization of [Fe(TalkylP)(OClO3)] and [Fe(TPrP)(THF)2]ClO4 (alkyl = Ethyl, Et and n-Propyl, Pr) Journal of Porphyrins and Phthalocyanines, 2013, 17, 118-124 |
1548832 | CIF HKL Paper | C14 H8 N2 S Se | P n a 21 | 20.8533; 9.9698; 23.4151 90; 90; 90 | 4868.1 | Schollmeyer, Dieter; Detert, Heiner Dibenzo[2,3:6,7]thiepino[4,5-<i>d</i>][1,2,3]selenadiazole IUCrData, 2018, 3, x180070 |
1549148 | CIF | C32 H34 B N S | P n a 21 | 32.54; 9.129; 9.286 90; 90; 90 | 2758 | Shi, Yong-Gang; Mellerup, Soren K.; Yuan, Kang; Hu, Guo-Fei; Sauriol, Francoise; Peng, Tai; Wang, Nan; Chen, Pangkuan; Wang, Suning Stabilising fleeting intermediates of stilbene photocyclization with amino-borane functionalisation: the rare isolation of persistent dihydrophenanthrenes and their [1,5] H-shift isomers. Chemical science, 2018, 9, 3844-3855 |
1549358 | CIF HKL Paper | C16 H24 Br4 N2 Zn | P n a 21 | 11.0702; 26.0585; 7.7302 90; 90; 90 | 2229.95 | Aarthi, Ramkumar; Thiruvalluvar, Aravazhi Amalan; Ramachandra Raja, Chidambaram Bis(4-methylbenzylammonium) tetrabromidozincate IUCrData, 2018, 3, x180648 |
1549544 | CIF | C59 H50 Cl2 N4 O4 S2 | P n a 21 | 25.387; 27.537; 21.8595 90; 90; 90 | 15282 | Zhang, Hao; Wu, Yongzhen; Zhang, Weiwei; Li, Erpeng; Shen, Chao; Jiang, Huiyun; Tian, He; Zhu, Wei-Hong Low cost and stable quinoxaline-based hole-transporting materials with a D-A-D molecular configuration for efficient perovskite solar cells. Chemical science, 2018, 9, 5919-5928 |
1549639 | CIF | C28 H50 Li2 N4 O27 P6 | P n a 21 | 19.964; 9.417; 23.52 90; 90; 90 | 4422 | RAOUDHA, Bel Haj Salah; LAMIA, Khedhiri; MOHAMED, Rzaigui Crystal Structure of a Hybrid Cyclohexaphosphate: [o-C7H10NO]4Li2P6O18·5H2O X-ray Structure Analysis Online, 2010, 26, 45 |
1549661 | CIF | C20 H26 N2 O4 S | P n a 21 | 14.59; 9.6772; 28.074 90; 90; 90 | 3963.8 | Mondieig, D.; Négrier, Ph.; Léger, J. M.; Massip, S.; Benali, B.; Jermoumi, C.; Lakhrissi, B. Crystal Structure of 2-S-(1′-Deoxy-2′,3′:4′,5′-di-O-isopropylidene-D,L-xylit-1′-ylthio)-3-methylquinoxaline X-ray Structure Analysis Online, 2010, 26, 1 |
1549720 | CIF HKL Paper | C14 H18 N2 O3 | P n a 21 | 12.2836; 14.5343; 7.8596 90; 90; 90 | 1403.2 | Rasheeda, Kedila; Samshuddin, Seranthimata; Swathi, Phadke N.; Alva, Vijaya D. P.; Mague, Joel T.; Ramli, Youssef 2-(4-Hydroxyphenyl)-4,6-dimethyl-2,3-dihydropyrimidin-1-ium acetate IUCrData, 2018, 3, x181046 |
1549908 | CIF | C22 H18 N2 | P n a 21 | 13.252; 5.704; 42.601 90; 90; 90 | 3220 | Kawada, Yuiki; Ohmura, Shunsuke; Kobayashi, Misaki; Nojo, Wataru; Kondo, Masaki; Matsuda, Yuka; Matsuoka, Junpei; Inuki, Shinsuke; Oishi, Shinya; Wang, Chao; Saito, Tatsuo; Uchiyama, Masanobu; Suzuki, Takanori; Ohno, Hiroaki Direct synthesis of aryl-annulated [<i>c</i>]carbazoles by gold(i)-catalysed cascade reaction of azide-diynes and arenes. Chemical science, 2018, 9, 8416-8425 |
1549949 | CIF | C10 H12 N2 | P n a 21 | 8.6825; 42.095; 9.7523 90; 90; 90 | 3564.4 | Zuñiga, Fco. Javier; Cruz-Cabeza, Aurora J.; Aretxabaleta, Xabier M.; de la Pinta, Noelia; Breczewski, Tomasz; Quesada-Moreno, María Mar; Avilés-Moreno, Juan Ramón; López-González, Juan Jesús; Claramunt, Rosa M.; Elguero, Jose Conformational aspects of polymorphs and phases of 2-propyl-1<i>H</i>-benzimidazole IUCrJ, 2018, 5 |
1550029 | CIF | C14 H22 N2 O | P n a 21 | 23.0581; 16.6608; 15.1185 90; 90; 90 | 5808 | Peveler, William J.; Packman, Hollie; Alexander, Shirin; Chauhan, Raamanand R.; Hayes, Lilian M.; Macdonald, Thomas J.; Cockcroft, Jeremy K.; Rogers, Sarah; Aarts, Dirk G. A. L.; Carmalt, Claire J.; Parkin, Ivan P.; Bear, Joseph C. A new family of urea-based low molecular-weight organogelators for environmental remediation: the influence of structure. Soft matter, 2018, 14, 8821-8827 |
1550140 | CIF | C25 H21 F2 N O2 Pt | P n a 21 | 27.0937; 11.3331; 6.7354 90; 90; 90 | 2068.14 | Mayder, Don M.; Thompson, Kyle A.; Christopherson, Cheyenne J.; Paisley, Nathan R.; Hudson, Zachary M. An efficient room-temperature synthesis of highly phosphorescent styrenic Pt(ii) complexes and their polymerization by ATRP Polymer Chemistry, 2018, 9, 5418 |
1550141 | CIF | C25 H23 N O2 Pt | P n a 21 | 26.595; 11.416; 6.7344 90; 90; 90 | 2044.6 | Mayder, Don M.; Thompson, Kyle A.; Christopherson, Cheyenne J.; Paisley, Nathan R.; Hudson, Zachary M. An efficient room-temperature synthesis of highly phosphorescent styrenic Pt(ii) complexes and their polymerization by ATRP Polymer Chemistry, 2018, 9, 5418 |
1550219 | CIF | C44 H60 Cu2 O12 S4 | P n a 21 | 14.0648; 22.4851; 15.6445 90; 90; 90 | 4947.5 | Knöfel, Nicolai D.; Rothfuss, Hannah; Barner-Kowollik, Christopher; Roesky, Peter W. M24+ paddlewheel clusters as junction points in single-chain nanoparticles Polymer Chemistry, 2019, 10, 86 |
1550309 | CIF | C39 H47 Cl N2 O | P n a 21 | 18.4291; 13.1243; 14.5076 90; 90; 90 | 3508.9 | Mandal, Swadhin K.; Sau, Samaresh Ch; Bhattacharjee, Rameswar; Hota, Pradip kumar; Vardhanapu, Pavan Kumar; vijaykumar, gonela; Govindarajan, R.; Datta, Ayan Transforming Atmospheric CO2 into Alternative Fuels: a Metal-Free Approach under Ambient Conditions Chemical Science, 2019 |
1550345 | CIF | C23 H23 B2 Cl9 N4 O2 | P n a 21 | 15.8691; 12.5093; 15.8466 90; 90; 90 | 3145.73 | Wang, Baolin; Kinjo, Rei Boron-based Stepwise Dioxygen Activation with 1,4,2,5-Diazadiborinine Chemical Science, 2019 |
1550416 | CIF | C79 H106 N18 O14 P | P n a 21 | 20.4627; 15.7895; 25.0638 90; 90; 90 | 8098 | Zuo, Wei; Jia, Chuandong; Zhang, Huizheng; Zhao, Yanxia; Yang, Xiao-Juan; Wu, Biao Selective recognition of choline phosphate by tripodal hexa-urea receptors with dual binding sites: crystal and solution evidence Chemical Science, 2019 |
1550425 | CIF | C62 H46 Cl8 N8 O5 | P n a 21 | 34.5017; 10.56728; 14.7887 90; 90; 90 | 5391.8 | Gozálvez, Cristian; Zafra, José L.; Saeki, Akinori; Melle-Franco, Manuel; Casado Cordón, Juan; Mateo-Alonso, Aurelio Charge Transport Modulation in Pseudorotaxane 1D Stacks of Acene and Azaacene Derivatives Chemical Science, 2019 |
1550467 | CIF | C8 H20 Cl3 Ga N4 | P n a 21 | 14.5269; 7.3499; 12.7491 90; 90; 90 | 1361.2 | Wang, Ni; Lei, Haitao; Zhang, Zongyao; Li, Jianfeng; Zhang, Wei; Cao, Rui Electrocatalytic hydrogen evolution with gallium hydride and ligand-centered reduction Chemical Science, 2019 |
1550469 | CIF | C2 H6 F3 N O6 S2 | P n a 21 | 8.9227; 18.531; 5.5268 90; 90; 90 | 913.8 | D'Amato, Erica M.; Börgel, Jonas; Ritter, Tobias Aromatic C‒H amination in hexafluoroisopropanol Chemical Science, 2019 |
1550512 | CIF | C41 H28 O2 | P n a 21 | 9.7427; 13.5639; 21.658 90; 90; 90 | 2862.1 | Zhang, Jinlong; Zhu, Lu; Shen, Kang; Yang, Huameng; Hang, Xiao-Chun; Jiang, Gaoxi Brønsted acid-catalyzed aromatic annulation of alkoxyallenes with naphthols: a reaction sequence to larger π-conjugated naphthopyrans with aggregation-induced emission characters Chemical Science, 2019 |
1550518 | CIF HKL | C27 H17 Cl O | P n a 21 | 14.0201; 17.4488; 7.8775 90; 90; 90 | 1927.1 | Roy Choudhury, Anuradha; Paul, Satya B.; Choudhury, Sudip 14-(4-Chlorophenyl)-14<i>H</i>-dibenzo[<i>a</i>,<i>j</i>]xanthene IUCrData, 2019, 4, x181846 |
1550567 | CIF HKL Paper | C19 H20 O6 | P n a 21 | 7.7143; 28.907; 7.501 90; 90; 90 | 1672.7 | Lee, Ji Hye; Koh, Dongsoo (<i>E</i>)-1-(2-Hydroxy-6-methoxyphenyl)-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-one IUCrData, 2019, 4, x190179 |
1550645 | CIF HKL Paper | C22 H21 F N8 O | P n a 21 | 12.2574; 7.6912; 22.821 90; 90; 90 | 2151.4 | El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Yousif, Emad; Alotaibi, Mohammad Hayal; Hegazy, Amany S.; Kariuki, Benson M. 1-(4-Fluorophenyl)-5-methyl-<i>N</i>'-{1-[5-methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazol-4-yl]ethylidene}-1<i>H</i>-1,2,3-triazole-4-carbohydrazide IUCrData, 2019, 4, x190261 |
1550661 | CIF | C32 H26 Br0.8 Cl1.2 N2 O2 | P n a 21 | 18.9449; 9.4629; 14.4914 90; 90; 90 | 2597.93 | Grobelny, Anna L.; Rath, Nigam P.; Groeneman, Ryan H. Regioselective photoreactions within a series of mixed co-crystals containing isosteric dihalogenated resorcinols with 4-stilbazole. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2019, 18, 989-992 |
1550749 | CIF | C9 H9 N7 O | P n a 21 | 12.569; 22.176; 3.6728 90; 90; 90 | 1023.7 | Wang, Chunling; Song, Chuanqqi; Shen, Wen-Hui; Qi, Yuan-Yuan; Xue, Ying; Shi, Yao-Cheng; Yu, Huaguang; Feng, Ligang A two-dimensional Ni(II) coordination polymer based on 3,5-bis(1’,2’,4’-triazol-1’-yl) pyridine ligand for water electro-oxidation Catalysis Science & Technology, 2019 |
1550913 | CIF | C26 H18 N2 O3 | P n a 21 | 22.596; 3.8694; 22.166 90; 90; 90 | 1938 | Shiga, Keigo; Gridnev, Ilya D.; Terada, Masahiro; Nakamura, Itaru Au-Catalyzed Skeletal Rearrangement of O-Propargylic Oximes via N-O Bond Cleavage with the Aid of a Brønsted Base Cocatalyst Chemical Science, 2019 |
1550945 | CIF HKL Paper | C34 H24 Br2 Fe | P n a 21 | 24.2914; 14.3317; 7.5014 90; 90; 90 | 2611.5 | Peloquin, Andrew J.; Smith, Madelyn B.; Balaich, Gary J.; Iacono, Scott T. 1,1'-Bis(4-bromophenyl)-3,3'-diphenylferrocene IUCrData, 2019, 4, x190487 |
1551260 | CIF | C16 H22 Cu N2 O9 | P n a 21 | 13.5554; 12.9227; 10.2747 90; 90; 90 | 1799.84 | May, Nóra V.; Gál, G. Tamás; Szentendrei, Zsolt; Korecz, László; May, Zoltán; Ferlin, Maria Grazia; Dean, Annalisa; Bombicz, Petra; Di Marco, Valerio B. Relationship between solid state structure and solution stability of copper(ii)‒hydroxypyridinecarboxylate complexes New Journal of Chemistry, 2019, 43, 10699 |
1551537 | CIF | C10 H12 N2 O | P n a 21 | 12.595; 6.2362; 11.529 90; 90; 90 | 905.5 | MITSUHASHI, Ryoji; MIKURIYA, Masahiro Crystal Structure of 2-(4-Methylimidazolin-2-yl)phenol: an Another Polymorph X-ray Structure Analysis Online, 2019, 35, 9 |
1551581 | CIF | C21 H22 B N O | P n a 21 | 16.6818; 11.5428; 9.2234 90; 90; 90 | 1776 | SAKIYAMA, Hiroshi; ICHI, Misaki; MITSUHASHI, Ryoji; MIKURIYA, Masahiro Crystal Structure of a Tetracoordinate Organoboron Coordination Compound, Dimethylformamide-triphenylborane Complex X-ray Structure Analysis Online, 2017, 33, 29 |
1551764 | CIF | C21 H24 N2 O2 | P n a 21 | 22.9565; 6.3725; 24.6677 90; 90; 90 | 3608.6 | RAJNIKANT,; KOHLI, Sabeta; SARMAL, Lovely; MEHDI, Sayed Hasan; PARVEEN, Mehtab Crystal Structure of 4,4-Dimethyl-1-[2-phenyl-1-(phenylamino)ethyl]-piperidin-2,6-dione X-ray Structure Analysis Online, 2010, 26, 17 |
1551817 | CIF | C16 H16 O2 S | P n a 21 | 7.5424; 11.9347; 15.2506 90; 90; 90 | 1372.8 | POOR HERAVI, Mohammad R.; LOGHMANI-KHOUZANI, Hossein; SADEGHI, Majid M. M.; ZENDEHDEL, Mahmoud; JACKSON, Richard F. W.; ADAMS, H. Crystal Structure of 2-(4-Methoxybenzylthio)-1-phenylethanone X-ray Structure Analysis Online, 2009, 25, 43 |
1551862 | CIF | C12 H13 Cl N4 O5 S2 | P n a 21 | 29.442; 7.3421; 7.0867 90; 90; 90 | 1531.9 | Bolla, Geetha; Nangia, Ashwini Supramolecular synthon hierarchy in sulfonamide cocrystals with <i>syn</i>-amides and <i>N</i>-oxides IUCrJ, 2019, 6 |
1551955 | CIF | C35.4 H34.6 B O4 | P n a 21 | 13.313; 11.317; 22.471 90; 90; 90 | 3385.6 | Ando, Naoki; Soutome, Hiroki; Yamaguchi, Shigehiro Near-Infrared Fluorescein Dyes Containing a Tricoordinate Boron Atom Chemical Science, 2019 |
1551963 | CIF | C33 H77 As N4 Si3 U | P n a 21 | 16.04632; 12.55844; 20.9096 90; 90; 90 | 4213.63 | Benedict M. Gardner; Gabor Balazs; Manfred Scheer; Floriana Tuna; Eric J. L. McInnes; Jonathan McMaster; William Lewis; Alexander J. Blake; Stephen T. Liddle Triamidoamine uranium(IV)-arsenic complexes containing one-, two- and threefold U-As bonding interactions Nature Chemistry, 2015, 7, 582-590 |
1552209 | CIF | C62 H78 N4 O Si2 | P n a 21 | 31.3225; 12.3379; 14.6291 90; 90; 90 | 5653.5 | El Abbassi, Maria; Zwick, Patrick; Rates, Alfredo; Stefani, Davide; Prescimone, Alessandro; Mayor, Marcel; van der Zant, Herre S. J.; Dulić, Diana Unravelling the conductance path through single-porphyrin junctions Chemical Science, 2019 |
1552262 | CIF | C54 H25 Cd4 N9 O25 | P n a 21 | 20.1853; 12.0295; 28.4889 90; 90; 90 | 6917.6 | Cui, Ruixue; Wan, Yongyan; Ji, Guanfeng; Liu, Zhiliang Highly Selective and Sensitive Fluorescent Sensor Based on Tb3+ Functionalized MOFs to Determinate Arginine in Urine: A Potential Application for Diagnosis of Cystinuria The Analyst, 2019 |
1552323 | CIF | C21 H18 | P n a 21 | 10.9002; 20.0267; 7.6356 90; 90; 90 | 1666.81 | Sherburn, Michael; George, Josemon; Ward, Jas S. A General Synthesis of Dendralenes Chemical Science, 2019 |
1552328 | CIF | C16 H16 Cl2 N2 O3 Pt S | P n a 21 | 12.476; 21.4728; 7.00394 90; 90; 90 | 1876.32 | Deng, Jungang; Yu, Ping; zhang, zhenlei; zhang, juzheng; Zhewen, Sun; Cai, Meiling; Yuan, Haoliang; Liang, Hong; Yang, Feng Novel Pt(II) complexes with modified aroyl-hydrazone Schiff-base ligands: synthesis, cytotoxicity and action mechanism Metallomics, 2019 |
1552347 | CIF | C47 H94 Cl2 F3 N4 O3 P4 S W2 | P n a 21 | 19.7515; 13.2485; 22.2689 90; 90; 90 | 5827.3 | Schluschaß, Bastian; Abbenseth, Josh; Demeshko, Serhiy; Finger, Markus; Franke, Alicja; Herwig, Christian; Würtele, Christian; Ivanović-Burmazović, Ivana; Limberg, Christian; Telser, Joshua; Schneider, Sven Selectivity of Tungsten Mediated Dinitrogen Splitting vs. Proton Reduction Chemical Science, 2019 |
1552356 | CIF HKL Paper | C21 H18 O4 | P n a 21 | 14.822; 5.2416; 20.8364 90; 90; 90 | 1618.8 | Sung, Jiha (<i>E</i>)-1-(2-Hydroxy-6-methoxyphenyl)-3-(2-methoxynaphthalen-1-yl)prop-2-en-1-one IUCrData, 2019, 4, x191281 |
1552472 | CIF | C19 H18 N P3 | P n a 21 | 26.5691; 10.80809; 5.9932 90; 90; 90 | 1721.01 | Schoemaker, Robin; Schwedtmann, Kai; Franconetti, Antonio; Frontera, Antonio; Hennersdorf, Felix; Weigand, Jan J. Controlled scrambling reactions to polyphosphanes via bond metathesis reactions Chemical Science, 2019 |
1552754 | CIF | Al B3 Cs F O6 | P n a 21 | 8.064; 11.97; 7.036 90; 90; 90 | 679.2 | Liu, Hongkun; Wang, Ying; Zhang, Bingbing; Yang, Zhihua; Pan, Shilie CsAlB3O6F: a beryllium-free deep-ultraviolet nonlinear optical material with enhanced thermal stability Chemical Science, 2020, 11, 694-698 |
1552892 | CIF | C10 H7 B F2 N2 O S | P n a 21 | 15.855; 13.112; 4.9675 90; 90; 90 | 1032.7 | Yamaji, Minoru; Tomonari, Kazuhiro; Ikuma, Keisuke; Goto, Kenta; Tani, Fumito; Okamoto, Hideki Blue fluorescence from N,O-coordinated BF2 complexes having aromatic chromophores in solution and solid state Photochemical & Photobiological Sciences, 2019 |
1553081 | CIF | C33 H44 Li N O3 Si | P n a 21 | 18.7063; 11.4184; 13.9803 90; 90; 90 | 2986.1 | Brennan, Marshall R.; Kim, Dongyoung; Fout, Alison R. A synthetic and mechanistic investigation into the cobalt(i) catalyzed amination of aryl halides Chem. Sci., 2014, 5, 4831 |
1553142 | CIF | C14 H15 Br N2 O3 | P n a 21 | 7.1573; 21.4898; 9.4975 90; 90; 90 | 1460.8 | Hu, Ying; Zhou, Zijun; Gong, Lei; Meggers, Eric Asymmetric aza-Henry reaction to provide oxindoles with quaternary carbon stereocenter catalyzed by a metal-templated chiral Brønsted base Organic Chemistry Frontiers, 2015, 2, 968 |
1553150 | CIF | C72 H74 I2 N36 O16 | P n a 21 | 13.093; 25.621; 27.14 90; 90; 90 | 9104 | Zhou, Tian-You; Qi, Qiao-Yan; Zhang, Ying; Xu, Xiao-Na; Zhao, Xin A thermally stable pH-responsive “supramolecular buckle” based on the encapsulation of 4-(4-aminophenyl)-N-methylpyridinium by cucurbit[8]uril Organic Chemistry Frontiers, 2015, 2, 1030 |
1553454 | CIF | C44 H49 Cl2 N3 O3 Ru S | P n a 21 | 16.8326; 12.2762; 20.4575 90; 90; 90 | 4227.3 | Sabbasani, Venkata R.; Yun, Sang Young; Lee, Daesung Structure and reactivity of sulfonamide- and acetate-chelated ruthenium alkylidene complexes Organic Chemistry Frontiers, 2016, 3, 939 |
1553599 | CIF | C46 H32 | P n a 21 | 16.8864; 7.4906; 24.7447 90; 90; 90 | 3129.94 | Lo, Yuan-Chih; Ting, Hao-Chun; Li, Ya-Ze; Li, Yi-Hua; Liu, Shun-Wei; Huang, Kuo-Wei; Wong, Ken-Tsung The synthesis, structure, and properties of 5,6,11,12-tetraarylindeno[1,2-b]fluorenes and their applications as donors for organic photovoltaic devices Organic Chemistry Frontiers, 2017, 4, 675 |
1553614 | CIF | C13 H12 N2 O | P n a 21 | 9.077; 10.4; 11.75 90; 90; 90 | 1109.2 | Guo, Wei-Si; Wang, Yuan-Chao; Dou, Qian; Wen, Li-Rong; Li, Ming A copper-catalyzed arylation/nucleophilic addition/fragmentation/C‒S bond formation cascade: synthesis of bis(arylthio)imines Organic Chemistry Frontiers, 2017, 4, 510 |
1553737 | CIF | C76 H39 N O9 | P n a 21 | 21.489; 10.179; 22.215 90; 90; 90 | 4859.2 | Xu, Dan; Li, Yanbang; Lou, Ning; Gan, Liangbing Synthesis of homoazafullerene [C59N(CH2)]R and azahomoazafullerene [C59N(NH)]R Organic Chemistry Frontiers, 2017, 4, 750 |
1553782 | CIF | C21 H18 F2 O4 | P n a 21 | 12.326; 11.032; 13.445 90; 90; 90 | 1828.3 | Li, Yuewen; Lu, Yiye; Mao, Runyu; Li, Zhiming; Wu, Jie A photoinduced reaction of perfluoroalkyl halides with 1,3-diarylprop-2-yn-1-ones catalyzed by DABSO Organic Chemistry Frontiers, 2017, 4, 1745 |
1553925 | CIF | C8 H12 Cl Cu N4 O4 | P n a 21 | 24.106; 8.4201; 20.584 90; 90; 90 | 4178 | Cao, Bo; Wei, Yin; Shi, Min Indium(iii)-catalyzed intramolecular dearomative cycloaddition ofN-sulfonylaziridines to indoles: facile synthesis of tetracyclic pyrroloindoline skeletons Organic Chemistry Frontiers, 2018, 5, 423 |
1553961 | CIF | C22 H28 Cl F6 N4 P Ru | P n a 21 | 24.447; 12.95; 7.9 90; 90; 90 | 2501.1 | Roy, Bivas Chandra; Debnath, Subhankar; Chakrabarti, Kaushik; Paul, Bhaskar; Maji, Milan; Kundu, Sabuj ortho-Amino group functionalized 2,2′-bipyridine based Ru(ii) complex catalysed alkylation of secondary alcohols, nitriles and amines using alcohols Organic Chemistry Frontiers, 2018, 5, 1008 |
1554005 | CIF | C37 H24 | P n a 21 | 13.7193; 16.2571; 11.2574 90; 90; 90 | 2510.81 | Kobin, Björn; Behren, Sandra; Braun-Cula, Beatrice; Hecht, Stefan Photochemical Degradation of Various Bridge-Substituted Fluorene-Based Materials. The journal of physical chemistry. A, 2016, 120, 5474-5480 |
1554006 | CIF | C27 H22 | P n a 21 | 12.1659; 21.9295; 7.1708 90; 90; 90 | 1913.11 | Kobin, Björn; Behren, Sandra; Braun-Cula, Beatrice; Hecht, Stefan Photochemical Degradation of Various Bridge-Substituted Fluorene-Based Materials. The journal of physical chemistry. A, 2016, 120, 5474-5480 |
1554088 | CIF | C16 H11 N3 S2 | P n a 21 | 31.455; 5.6198; 23.722 90; 90; 90 | 4193.4 | Price, Jacquelyn T.; Li, Michelle S. M.; Brazeau, Allison L.; Tao, Danlei; Xiang, Guiming; Chen, Yanhua; McDonald, Robert; Jones, Nathan D.; Ding, Zhifeng Structural Insight into Electrogenerated Chemiluminescence of Para-Substituted Aryl‒Triazole‒Thienyl Compounds The Journal of Physical Chemistry C, 2016, 120, 21778 |
1554383 | CIF | C25 H33 Mg N2 | P n a 21 | 21.9804; 19.3508; 11.283 90; 90; 90 | 4799.1 | Li, Jia; Luo, Man; Sheng, Xingchao; Hua, Haiming; Yao, Weiwei; Pullarkat, Sumod A.; Xu, Li; Ma, Mengtao Unsymmetrical β-diketiminate magnesium(i) complexes: syntheses and application in catalytic hydroboration of alkyne, nitrile and carbonyl compounds Organic Chemistry Frontiers, 2018, 5, 3538 |
1554419 | CIF | C20 H18 | P n a 21 | 15.853; 12.375; 7.3639 90; 90; 90 | 1444.7 | Muthuramalingam, Somasundaram; Garg, Jai Anand; Karthick, R.; Fox, Thomas; Blacque, Olivier; Venkatesan, Koushik; Ramanathan, Saiganesh; Kabilan, Senthamaraikannan; Balasubramanian, K. K. Nickel catalyzed synthesis of 4,4′-bichromenes/4,4′-bithiochromenes and their Atropisomerism Organic Chemistry Frontiers, 2019, 6, 134 |
1554445 | CIF | C28 H29 Br Co P S | P n a 21 | 16.6717; 10.051; 14.516 90; 90; 90 | 2432.4 | Liu, Xiangyu; Wu, Chengjuan; Zhang, Jing; Shi, Yihan; Zhang, Shengnan; Geng, Yan; Tung, Chen-Ho; Wang, Wenguang Cobalt-catalyzed radical cyclization of isocyanides forming phenanthridine derivatives Organic Chemistry Frontiers, 2018, 5, 2997 |
1554480 | CIF | C15 H14 F6 N2 O5 S2 | P n a 21 | 27.2048; 18.3507; 12.2694 90; 90; 90 | 6125.2 | Almendros, Pedro; Yanai, Hikaru; Hoshikawa, Shoki; Aragoncillo, Cristina; Lázaro-Milla, Carlos; Toledano-Pinedo, Mireia; Matsumoto, Takashi; Alcaide, Benito Transition metal-free controlled synthesis of bis[(trifluoromethyl)sulfonyl]ethyl-decorated heterocycles Organic Chemistry Frontiers, 2018, 5, 3163 |
1554525 | CIF | C26 H38 N6 O9 S2 | P n a 21 | 15.1627; 6.4915; 29.4057 90; 90; 90 | 2894.4 | Savastano, Matteo; Bazzicalupi, Carla; García-Gallarín, Celeste; López de la Torre, Maria Dolores; Bianchi, Antonio; Melguizo, Manuel Supramolecular forces and their interplay in stabilizing complexes of organic anions: tuning binding selectivity in water Organic Chemistry Frontiers, 2019, 6, 75 |
1554530 | CIF | C3 H3 F N6 O4 | P n a 21 | 11.4331; 5.7212; 11.2434 90; 90; 90 | 735.44 | Palysaeva, Nadezhda V.; Gladyshkin, Aleksei G.; Vatsadze, Irina A.; Suponitsky, Kyrill Yu.; Dmitriev, Dmitry E.; Sheremetev, Aleksei B. N-(2-Fluoro-2,2-dinitroethyl)azoles: a novel assembly of diverse explosophoric building blocks for energetic compound design Organic Chemistry Frontiers, 2019, 6, 249 |
1554562 | CIF | C25.5 H28 Cl N4 O2.5 Pd | P n a 21 | 25.795; 9.144; 21.256 90; 90; 90 | 5013.6 | Sun, Wen-Wu; Liu, Ji-Kai; Wu, Bin Practical synthesis of polysubstituted unsymmetric 1,10-phenanthrolines by palladium catalyzed intramolecular oxidative cross coupling of C(sp2)–H and C(sp3)–H bonds of carboxamides Organic Chemistry Frontiers, 2019, 6, 544 |
1554624 | CIF | C48 H58 B Co Fe S3 | P n a 21 | 20.2817; 17.2944; 12.4241 90; 90; 90 | 4357.9 | Zhang, Yahui; Yang, Dawei; Li, Ying; Zhao, Xiangyu; Wang, Baomin; Qu, Jingping Biomimetic catalytic oxidative coupling of thiols using thiolate-bridged dinuclear metal complexes containing iron in water under mild conditions Catalysis Science & Technology, 2019, 9, 6492 |
1554625 | CIF | C47 H56 B Co Fe S3 | P n a 21 | 20.576; 16.9755; 12.0227 90; 90; 90 | 4199.4 | Zhang, Yahui; Yang, Dawei; Li, Ying; Zhao, Xiangyu; Wang, Baomin; Qu, Jingping Biomimetic catalytic oxidative coupling of thiols using thiolate-bridged dinuclear metal complexes containing iron in water under mild conditions Catalysis Science & Technology, 2019, 9, 6492 |
1554719 | CIF | C30 H44 F4 N2 S2 Si2 | P n a 21 | 19.9633; 12.2859; 13.3676 90; 90; 90 | 3278.6 | Barłóg, Maciej; Kulai, Ihor; Ji, Xiaozhou; Bhuvanesh, Nattamai; Dey, Somnath; Sliwinski, Eric Pierre; Bazzi, Hassan S.; Fang, Lei; Al-Hashimi, Mohammed Synthesis, characterization and crystal structures of novel fluorinated di(thiazolyl)benzene derivatives Organic Chemistry Frontiers, 2019, 6, 780 |
1554864 | CIF | C14 H11 N O7 | P n a 21 | 8.6933; 19.9383; 7.6281 90; 90; 90 | 1322.18 | Dorfner, Walter L.; Carroll, Patrick J.; Schelter, Eric J. Substituted quinoline quinones as surrogates for the PQQ cofactor: an electrochemical and computational study. Organic letters, 2015, 17, 1850-1853 |
1554922 | CIF | C31 H28 N2 O5 | P n a 21 | 21.4324; 13.5256; 8.8733 90; 90; 90 | 2572.2 | Zhang, Si-Chen; Lei, Xin-Xin; Yang, Yong-jian; Luo, Yong-Chun; Zhang, Huan-Huan; Xu, Peng-Fei Palladium catalysed [3 + 2]-annulation reaction of vinylcyclopropanes with pentafulvenes: synthesis of polysubstituted spiro[4,4]nona-6,8-dienes Organic Chemistry Frontiers, 2019, 6, 2415 |
1554933 | CIF | C10 H8 N2 S | P n a 21 | 15.971; 4.2214; 13.319 90; 90; 90 | 898 | Peng, Yingyuan; He, Qian; Zhang, Xiaofei; Yang, Chunhao Pd-Catalyzed intramolecular C‒H activation and C‒S formation to synthesize pyrazolo[5,1-b]benzothiazoles without an additional oxidant Organic Chemistry Frontiers, 2019, 6, 3234 |
1555021 | CIF | C19 H18 O2 | P n a 21 | 12.91; 9.664; 12.157 90; 90; 90 | 1516.7 | Lewis, Robert S.; Garza, Christopher J.; Dang, Ann T.; Pedro, Te Kie A.; Chain, William J. Michael Additions of Highly Basic Enolates to ortho-Quinone Methides. Organic letters, 2015, 17, 2278-2281 |
1555180 | CIF | C32 H28 N2 O6 | P n a 21 | 32.9549; 12.7486; 24.5123 90; 90; 90 | 10298.3 | Chen, Meng-Ting; Zhang, Yang; Vysotsky, Myroslav O.; Lindner, Joachim O.; Li, Meng-Hua; Lin, Mei-Jin; Würthner, Frank 1,1′-Bi(2-naphthol-4,5-dicarboximide)s: blue emissive axially chiral scaffolds with aggregation-enhanced emission properties Organic Chemistry Frontiers, 2019, 6, 3731 |
1555199 | CIF | C23 H18 N2 O2 | P n a 21 | 28.7181; 16.094; 7.4702 90; 90; 90 | 3452.65 | Wössner, Jan S.; Grenz, David C.; Kratzert, Daniel; Esser, Birgit Tuning the optical properties of spiro-centered charge-transfer dyes by extending the donor or acceptor part Organic Chemistry Frontiers, 2019, 6, 3649 |
1555230 | CIF | C23 H25 F2 I N2 O4 S | P n a 21 | 24.1416; 10.1959; 20.5376 90; 90; 90 | 5055.2 | Wang, Yu-Qi; He, Yu-Tao; Zhang, Lu-Lu; Wu, Xin-Xing; Liu, Xue-Yuan; Liang, Yong-Min Palladium-Catalyzed Radical Cascade Iododifluoromethylation/Cyclization of 1,6-Enynes with Ethyl Difluoroiodoacetate. Organic letters, 2015, 17, 4280-4283 |
1555294 | CIF | C14 H13 N3 O3 S | P n a 21 | 8.9685; 11.8374; 12.3725 90; 90; 90 | 1313.51 | Liu, Wei; Li, Hou-Jin; Xu, Meng-Yang; Ju, Ying-Chen; Wang, Lai-You; Xu, Jun; Yang, De-Po; Lan, Wen-Jian Pseudellones A-C, Three Alkaloids from the Marine-Derived Fungus Pseudallescheria ellipsoidea F42-3. Organic letters, 2015, 17, 5156-5159 |
1555386 | CIF | C25 H24 N4 O4 | P n a 21 | 8.7914; 22.2498; 11.9566 90; 90; 90 | 2338.79 | Chingle, Ramesh; Lubell, William D. Azopeptides: Synthesis and Pericyclic Chemistry. Organic letters, 2015, 17, 5400-5403 |
1555435 | CIF | C22 H16 O4 | P n a 21 | 23.0883; 8.2485; 17.6035 90; 90; 90 | 3352.5 | Shyam Sundar, M.; Bedekar, Ashutosh V. Synthesis and Study of 7,12,17-Trioxa[11]helicene. Organic letters, 2015, 17, 5808-5811 |
1555465 | CIF | C21 H14 O4 | P n a 21 | 9.2786; 23.641; 7.5289 90; 90; 90 | 1651.5 | Zhao, Jidong; Liu, Jun; Xie, Xin; Li, Shi; Liu, Yuanhong Gold-Catalyzed Synthesis of Tropone and Its Analogues via Oxidative Ring Expansion of Alkynyl Quinols. Organic letters, 2015, 17, 5926-5929 |
1555485 | CIF | C22 H13 Cl F N3 O S | P n a 21 | 17.7894; 18.2676; 5.7336 90; 90; 90 | 1863.2 | Fan, Wei; Li, Qun; Li, Yanrong; Sun, Hao; Jiang, Bo; Li, Guigen I2/O2-Enabled N-S Bond Formation to Access Functionalized 1,2,3-Thiadiazoles. Organic letters, 2016, 18, 1258-1261 |
1555619 | CIF | C7 H5 I O3 | P n a 21 | 8.0841; 14.9751; 6.2629 90; 90; 90 | 758.19 | Jardim, Guilherme A. M.; Bower, John F.; da Silva Júnior, Eufrânio N Rh-Catalyzed Reactions of 1,4-Benzoquinones with Electrophiles: C-H Iodination, Bromination, and Phenylselenation. Organic letters, 2016, 18, 4454-4457 |
1555639 | CIF | C24 H17 N O | P n a 21 | 15.3059; 12.1881; 9.628 90; 90; 90 | 1796.1 | Chen, Si; Wu, Xin-Xing; Wang, Jia; Hao, Xin-Hua; Xia, Yu; Shen, Yi; Jing, Huanwang; Liang, Yong-Min Palladium-Catalyzed Intramolecular Dearomatization of Indoles via Decarboxylative Alkynyl Termination. Organic letters, 2016, 18, 4016-4019 |
1555690 | CIF | C27 H24 F N O2 | P n a 21 | 9.672; 25.53; 9.182 90; 90; 90 | 2267.3 | Rajesh, Manda; Puri, Surendra; Kant, Ruchir; Sridhar Reddy, Maddi Synthesis of Substituted Furan/Pyrrole-3-carboxamides through a Tandem Nucleopalladation and Isocyanate Insertion. Organic letters, 2016, 18, 4332-4335 |
1555708 | CIF | C18 H21 N3 | P n a 21 | 14.58554; 8.33918; 25.4351 90; 90; 90 | 3093.71 | Kim, Seyong; Jo, Junyong; Lee, Dongwhan Conformationally Distorted π-Conjugation for Reaction-Based Detection of Nickel: Fluorescence Turn-on by Twist-and-Fragment. Organic letters, 2016, 18, 4530-4533 |
1555763 | CIF | C25 H26 O6 | P n a 21 | 15.6433; 8.7737; 31.105 90; 90; 90 | 4269.1 | Qiao, Chuang; Zhang, Wen; Han, Jing-Chun; Li, Chuang-Chuang Catalytic Enantioselective Total Synthesis of Hypocrolide A. Organic letters, 2016, 18, 4932-4935 |
1555781 | CIF | C15 H25 Br O2 | P n a 21 | 10.9219; 22.3462; 13.7789 90; 90; 90 | 3362.9 | Shen, Minxing; Kretschmer, Manuel; Brill, Zachary G.; Snyder, Scott A. Strategies for the Total Synthesis of Diverse Bromo-Chamigrenes. Organic letters, 2016, 18, 5018-5021 |
1555799 | CIF | C15 H9 N O | P n a 21 | 14.933; 5.3922; 25.637 90; 90; 90 | 2064.3 | Jia, Feng-Cheng; Xu, Cheng; Zhou, Zhi-Wen; Cai, Qun; Wu, Yan-Dong; Wu, An-Xin Substrates as Electron-Donor Precursors: Synthesis of Naphtho-Fused Oxindoles via Benzannulation of 2-Halobenzaldehydes and Indolin-2-ones. Organic letters, 2016, 18, 5232-5235 |
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