Crystallography Open Database
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COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
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7203750 | CIF | C62 H62 Cd N4 O9 | C 1 2 1 | 24.024; 10.689; 10.982 90; 108.657; 90 | 2671.9 | Paul, Barbara; Näther, Christian; Fromm, Katharina M.; Janiak, Christoph Chiral S-1,1′-bi-2-naphthol (S-BINOL) as a synthon for supramolecular hydrogen-bonded {(S-BINOLATn‒)(S-BINOL)n}-strands with naphthyl-paneled cavities or channels for a Cd(NH3)4-fragment (n= 2) or [Ag(NH3)2]+(n= 1). Part 2 CrystEngComm, 2005, 7, 309 |
7203751 | CIF | C42 H39 Ag N2 O5 | P 1 | 9.373; 10.796; 18.074 78.215; 81.104; 89.636 | 1768.2 | Paul, Barbara; Näther, Christian; Fromm, Katharina M.; Janiak, Christoph Chiral S-1,1′-bi-2-naphthol (S-BINOL) as a synthon for supramolecular hydrogen-bonded {(S-BINOLATn‒)(S-BINOL)n}-strands with naphthyl-paneled cavities or channels for a Cd(NH3)4-fragment (n= 2) or [Ag(NH3)2]+(n= 1). Part 2 CrystEngComm, 2005, 7, 309 |
7203752 | CIF | C42 H39 Ag N2 O5 | P 1 | 9.3931; 10.8023; 18.105 78.274; 81.002; 89.577 | 1776 | Paul, Barbara; Näther, Christian; Fromm, Katharina M.; Janiak, Christoph Chiral S-1,1′-bi-2-naphthol (S-BINOL) as a synthon for supramolecular hydrogen-bonded {(S-BINOLATn‒)(S-BINOL)n}-strands with naphthyl-paneled cavities or channels for a Cd(NH3)4-fragment (n= 2) or [Ag(NH3)2]+(n= 1). Part 2 CrystEngComm, 2005, 7, 309 |
7203753 | CIF | C5.75 H4.38 Cl2.5 Co0.75 N4.13 | C 1 2/m 1 | 17.856; 20.231; 7.0472 90; 103.15; 90 | 2479 | Oxtoby, Neil S.; Champness, Neil R.; Wilson, Claire Cobalt and cadmium coordination polymers formed with the multimodal ligand 3,6-di-pyrazin-2-yl-(1,2,4,5)-tetrazine CrystEngComm, 2005, 7, 284 |
7203754 | CIF | C10 H6 Cd N10 O6 | C 1 2/c 1 | 18.0112; 6.3741; 13.9426 90; 109.359; 90 | 1510.2 | Oxtoby, Neil S.; Champness, Neil R.; Wilson, Claire Cobalt and cadmium coordination polymers formed with the multimodal ligand 3,6-di-pyrazin-2-yl-(1,2,4,5)-tetrazine CrystEngComm, 2005, 7, 284 |
7203756 | CIF | C76 H44 N18 O0.96 Zn2 | C 1 2 1 | 29.649; 21.016; 12.252 90; 92.14; 90 | 7629 | Zeng, Qingdao; Wu, Dongxia; Wang, Chen; Lu, Jun; Ma, Baocheng; Shu, Chunying; Ma, Hongwei; Li, Yan; Bai, Chunli Bipyridine conformations control the solid-state supramolecular chemistry of zinc(ii) phthalocyanine with bipyridines CrystEngComm, 2005, 7, 243 |
7203757 | CIF | C82 H56 N20 O2 Zn2 | P -1 | 10.886; 12.317; 14.535 65.05; 76.62; 70.07 | 1652.4 | Zeng, Qingdao; Wu, Dongxia; Wang, Chen; Lu, Jun; Ma, Baocheng; Shu, Chunying; Ma, Hongwei; Li, Yan; Bai, Chunli Bipyridine conformations control the solid-state supramolecular chemistry of zinc(ii) phthalocyanine with bipyridines CrystEngComm, 2005, 7, 243 |
7203758 | CIF | C45 H30 N10 Zn | P 1 21/n 1 | 9.2854; 20.135; 18.572 90; 90.15; 90 | 3472.2 | Zeng, Qingdao; Wu, Dongxia; Wang, Chen; Lu, Jun; Ma, Baocheng; Shu, Chunying; Ma, Hongwei; Li, Yan; Bai, Chunli Bipyridine conformations control the solid-state supramolecular chemistry of zinc(ii) phthalocyanine with bipyridines CrystEngComm, 2005, 7, 243 |
7203765 | CIF | C82 H74 Co2 N16 O7 S4 | P 1 21/c 1 | 15.754; 26.877; 19.244 90; 90.065; 90 | 8148 | Halder, Gregory J.; Neville, Suzanne M.; Kepert, Cameron J. A highly distorted (10,3)-a coordination framework constructed from alternating T-shaped and trigonal nodes CrystEngComm, 2005, 7, 266 |
7203766 | CIF | C82 H74 Fe2 N16 O7 S4 | P 1 21/c 1 | 15.772; 26.984; 19.254 90; 90.019; 90 | 8194 | Halder, Gregory J.; Neville, Suzanne M.; Kepert, Cameron J. A highly distorted (10,3)-a coordination framework constructed from alternating T-shaped and trigonal nodes CrystEngComm, 2005, 7, 266 |
7203776 | CIF | C14 H14 Cl2 N4 Zn | P 1 21 1 | 7.811; 11.056; 8.938 90; 98.02; 90 | 764.3 | Balamurugan, V.; Mukherjee, Rabindranath Homochiral 1D-helical metal‒organic frameworks from achiral components. Formation of chiral channel via C‒H⋯Cl interaction CrystEngComm, 2005, 7, 337 |
7203777 | CIF | C14 H14 Cl2 N4 Zn | P 1 21 1 | 7.6924; 10.9917; 8.9403 90; 97.213; 90 | 749.94 | Balamurugan, V.; Mukherjee, Rabindranath Homochiral 1D-helical metal‒organic frameworks from achiral components. Formation of chiral channel via C‒H⋯Cl interaction CrystEngComm, 2005, 7, 337 |
7203778 | CIF | C14 H14 Cl2 Co N4 | P 1 21 1 | 7.701; 10.977; 8.943 90; 97.15; 90 | 750.1 | Balamurugan, V.; Mukherjee, Rabindranath Homochiral 1D-helical metal‒organic frameworks from achiral components. Formation of chiral channel via C‒H⋯Cl interaction CrystEngComm, 2005, 7, 337 |
7203779 | CIF | C34 H32 N2 Ni O4 P2 S4 | P -1 | 8.989; 9.8015; 11.403 112.076; 94.424; 108.021 | 863.8 | Aragoni, M. Carla; Arca, Massimiliano; Champness, Neil R.; De Pasquale, Monica; Devillanova, Francesco A.; Isaia, Francesco; Lippolis, Vito; Oxtoby, Neil S.; Wilson, Claire Synthesis and structural characterisation of coordination polymers designed using discrete phosphonodithioato NiII complexes and dipyridyl donor ligands CrystEngComm, 2005, 7, 363 |
7203780 | CIF | C28 H28 N6 Ni O4 P2 S4 | P -1 | 7.4357; 9.7115; 12.026 70.913; 81.101; 80.143 | 804 | Aragoni, M. Carla; Arca, Massimiliano; Champness, Neil R.; De Pasquale, Monica; Devillanova, Francesco A.; Isaia, Francesco; Lippolis, Vito; Oxtoby, Neil S.; Wilson, Claire Synthesis and structural characterisation of coordination polymers designed using discrete phosphonodithioato NiII complexes and dipyridyl donor ligands CrystEngComm, 2005, 7, 363 |
7203781 | CIF | C30 H32 N6 Ni O4 P2 S4 | P -1 | 6.9179; 10.7325; 12.898 66.496; 86.813; 89.574 | 876.7 | Aragoni, M. Carla; Arca, Massimiliano; Champness, Neil R.; De Pasquale, Monica; Devillanova, Francesco A.; Isaia, Francesco; Lippolis, Vito; Oxtoby, Neil S.; Wilson, Claire Synthesis and structural characterisation of coordination polymers designed using discrete phosphonodithioato NiII complexes and dipyridyl donor ligands CrystEngComm, 2005, 7, 363 |
7203782 | CIF | C10 H10 Au Br4 Cl I2 N2 | P c c a | 16.113; 4.2049; 28.34 90; 90; 90 | 1920.1 | Zordan, Fiorenzo; Purver, Stephen L.; Adams, Harry; Brammer, Lee Halometallate and halide ions: nucleophiles in competition for hydrogen bond and halogen bond formation in halopyridinium salts of mixed halide‒halometallate anions CrystEngComm, 2005, 7, 350 |
7203783 | CIF | C15 H15 Cl12 Fe2 N3 | P 1 21/n 1 | 14.5518; 13.7363; 14.6547 90; 92.389; 90 | 2926.8 | Zordan, Fiorenzo; Purver, Stephen L.; Adams, Harry; Brammer, Lee Halometallate and halide ions: nucleophiles in competition for hydrogen bond and halogen bond formation in halopyridinium salts of mixed halide‒halometallate anions CrystEngComm, 2005, 7, 350 |
7203784 | CIF | C15 H15 Br3 Cl9 Fe2 N3 | P 1 21/n 1 | 14.583; 13.96; 14.695 90; 91.716; 90 | 2990 | Zordan, Fiorenzo; Purver, Stephen L.; Adams, Harry; Brammer, Lee Halometallate and halide ions: nucleophiles in competition for hydrogen bond and halogen bond formation in halopyridinium salts of mixed halide‒halometallate anions CrystEngComm, 2005, 7, 350 |
7203785 | CIF | C15 H15 Cl10 N3 Pt | P 1 21/n 1 | 9.894; 21.852; 11.64 90; 98.807; 90 | 2486.9 | Zordan, Fiorenzo; Purver, Stephen L.; Adams, Harry; Brammer, Lee Halometallate and halide ions: nucleophiles in competition for hydrogen bond and halogen bond formation in halopyridinium salts of mixed halide‒halometallate anions CrystEngComm, 2005, 7, 350 |
7203794 | CIF | C3 H15 N6 P S | P 63 | 9.1213; 9.1213; 7.1103 90; 90; 120 | 512.31 | Chandrasekhar, Vadapalli; Azhakar, Ramachandran A tubular architecture in a phosphorus based trihydrazide, {P(S)[N(CH3)NH2]3} CrystEngComm, 2005, 7, 346 |
7203795 | CIF | C3 H15 N6 O P | P b c a | 13.226; 9.956; 13.349 90; 90; 90 | 1757.8 | Chandrasekhar, Vadapalli; Azhakar, Ramachandran A tubular architecture in a phosphorus based trihydrazide, {P(S)[N(CH3)NH2]3} CrystEngComm, 2005, 7, 346 |
7204391 | CIF | C6 H5 Pb0.25 | P -4 21 c | 12.111; 12.111; 6.543 90; 90; 90 | 959.7 | Claborn, Kacey; Kahr, Bart; Kaminsky, Werner Calculations of optical properties of the tetraphenyl-X family of isomorphous crystals (X = C, Si, Ge, Sn, Pb) CrystEngComm, 2002, 4, 252-256 |
7204392 | CIF | C24 H20 Sn | P -4 21 c | 12.068; 12.068; 6.557 90; 90; 90 | 954.94 | Claborn, Kacey; Kahr, Bart; Kaminsky, Werner Calculations of optical properties of the tetraphenyl-X family of isomorphous crystals (X = C, Si, Ge, Sn, Pb) CrystEngComm, 2002, 4, 252-256 |
7204393 | CIF | C24 H20 Ge | P -4 21 c | 11.616; 11.616; 6.902 90; 90; 90 | 931.3 | Claborn, Kacey; Kahr, Bart; Kaminsky, Werner Calculations of optical properties of the tetraphenyl-X family of isomorphous crystals (X = C, Si, Ge, Sn, Pb) CrystEngComm, 2002, 4, 252-256 |
7204394 | CIF | C6 H5 Si0.25 | P -4 21 c | 11.4476; 11.4476; 7.0644 90; 90; 90 | 925.77 | Claborn, Kacey; Kahr, Bart; Kaminsky, Werner Calculations of optical properties of the tetraphenyl-X family of isomorphous crystals (X = C, Si, Ge, Sn, Pb) CrystEngComm, 2002, 4, 252-256 |
7204395 | CIF | C6.25 H5 | P -4 21 c | 10.905; 10.905; 7.285 90; 90; 90 | 866.33 | Claborn, Kacey; Kahr, Bart; Kaminsky, Werner Calculations of optical properties of the tetraphenyl-X family of isomorphous crystals (X = C, Si, Ge, Sn, Pb) CrystEngComm, 2002, 4, 252-256 |
7204509 | CIF | C9 H17 N7 O4 S | P 1 21/c 1 | 7.202; 11.18; 18.192 90; 100.48; 90 | 1440.4 | Grossel, Martin C.; Merckel, Daniel A. S.; Hutchings, Michael G. The effect of preorganisation on the solid state behaviour of simple 'aromatic-cored' bis(guanidinium) sulfatesElectronic supplementary information (ESI) available: full details of crystallographic data collection for compounds 2·H2SO4 and 3·H2SO4·2H2O. See http://www.rsc.org/suppdata/ce/b2/b207803a/ CrystEngComm, 2003, 5, 77 |
7204510 | CIF | C10 H18 N6 O8 S | C 1 2/c 1 | 9.4365; 23.7247; 7.0598 90; 93.656; 90 | 1577.32 | Grossel, Martin C.; Merckel, Daniel A. S.; Hutchings, Michael G. The effect of preorganisation on the solid state behaviour of simple 'aromatic-cored' bis(guanidinium) sulfatesElectronic supplementary information (ESI) available: full details of crystallographic data collection for compounds 2·H2SO4 and 3·H2SO4·2H2O. See http://www.rsc.org/suppdata/ce/b2/b207803a/ CrystEngComm, 2003, 5, 77 |
7204546 | CIF | C22 H36 Cl2 Cu N8 O4 | P 1 21/c 1 | 8.5807; 14.25; 12.114 90; 109.853; 90 | 1393.2 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire Complementarity of halide-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids using bis(N-alkylamidino-O-alkylurea)copper(ii) halides CrystEngComm, 2003, 5, 10 |
7204547 | CIF | C10 H24 Br2 Cu N8 O2 | P -1 | 9.036; 12.689; 16.37 94.62; 97.051; 91.02 | 1856 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire Complementarity of halide-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids using bis(N-alkylamidino-O-alkylurea)copper(ii) halides CrystEngComm, 2003, 5, 10 |
7204548 | CIF | C12 H30 Cl2 Cu N8 O3 | P 1 21/c 1 | 10.859; 24.988; 7.662 90; 96.259; 90 | 2066.7 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire Complementarity of halide-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids using bis(N-alkylamidino-O-alkylurea)copper(ii) halides CrystEngComm, 2003, 5, 10 |
7204549 | CIF | C13 H32 Br2 Cu N8 O3 | P -1 | 7.6304; 12.062; 12.964 71.233; 78.914; 80.827 | 1102.5 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire Complementarity of halide-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids using bis(N-alkylamidino-O-alkylurea)copper(ii) halides CrystEngComm, 2003, 5, 10 |
7204550 | CIF | C10 H28 Br2 Cu N8 O4 | P 1 21/c 1 | 5.223; 16.539; 11.802 90; 102.806; 90 | 994.1 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire Complementarity of halide-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids using bis(N-alkylamidino-O-alkylurea)copper(ii) halides CrystEngComm, 2003, 5, 10 |
7204551 | CIF | C8 H20 Cl2 Cu N8 O2 | P 1 21/c 1 | 5.2682; 13.403; 11.065 90; 94.56; 90 | 778.8 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire Complementarity of halide-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids using bis(N-alkylamidino-O-alkylurea)copper(ii) halides CrystEngComm, 2003, 5, 10 |
7204552 | CIF | C16 H13 N O4 | P 1 21 1 | 6.983; 16.174; 12.36 90; 99.31; 90 | 1377.6 | Smith, Graham; Wermuth, Urs D.; White, Jonathan M. Facile solid-state molecular assembly: the crystal structure of the unique 2∶2 proton-transfer oxine-salicylic acid compound CrystEngComm, 2003, 5, 58 |
7204555 | CIF | C32 H40 N2 O3 | P c a 21 | 17.17; 14.26; 24.02 90; 90; 90 | 5881 | Fan, Ailong; Valiyaveettil, Suresh; Vittal, Jagadese J. Monohelical self-assembly of 5-alkoxyisophthalamides CrystEngComm, 2003, 5, 38 |
7204559 | CIF | C12 H28 Cu N10 O8 | P 1 21/n 1 | 5.383; 15.581; 12.685 90; 101.746; 90 | 1041.6 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire Complementarity of anion-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids by bis(N-alkylamidino-O-alkylurea)copper(ii) nitrates and tetrafluoroborates CrystEngComm, 2003, 5, 23 |
7204560 | CIF | C12 H28 B2 Cu F8 N8 O2 | P 1 21 1 | 5.2725; 15.204; 13.9432 90; 99.532; 90 | 1102.3 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire Complementarity of anion-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids by bis(N-alkylamidino-O-alkylurea)copper(ii) nitrates and tetrafluoroborates CrystEngComm, 2003, 5, 23 |
7204561 | CIF | C22.5 H35 Cu N10 O9 | P -1 | 11.1621; 16.1935; 17.328 83.861; 74.106; 81.143 | 2969.5 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire Complementarity of anion-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids by bis(N-alkylamidino-O-alkylurea)copper(ii) nitrates and tetrafluoroborates CrystEngComm, 2003, 5, 23 |
7204562 | CIF | C10 H24 Cu N10 O8 | P 1 21/n 1 | 5.03; 15.4696; 12.3914 90; 95.916; 90 | 959.07 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire Complementarity of anion-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids by bis(N-alkylamidino-O-alkylurea)copper(ii) nitrates and tetrafluoroborates CrystEngComm, 2003, 5, 23 |
7204563 | CIF | C10 H24 B2 Cu F8 N8 O2 | P 1 21/n 1 | 5.118; 14.676; 13.913 90; 99.989; 90 | 1029.2 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire Complementarity of anion-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids by bis(N-alkylamidino-O-alkylurea)copper(ii) nitrates and tetrafluoroborates CrystEngComm, 2003, 5, 23 |
7204564 | CIF | C5 H11 Co N O6 | P 21 21 21 | 7.149; 10.468; 11.295 90; 90; 90 | 845.3 | Zhang, Yugen; Saha, Manas K.; Bernal, Ivan [Cobalt(ii)l-glutamate(H2O)·H2O]∞: a new 3D chiral metal‒organic interlocking network with channels CrystEngComm, 2003, 5, 34 |
7204565 | CIF | C54 H36 Cl2 N16 | P -1 | 8.135; 12.011; 12.048 79.86; 89.486; 78.146 | 1133.7 | Akutagawa, Tomoyuki; Hasegawa, Tatsuo; Nakamura, Takayoshi; Saito, Gunzi Hydrogen-bonded supramolecular (2,2'-bi-1H-benzimidazole)(2-(2-1H-benzimidazolyl)-1H-benzimidazolium+)2(Cl‒) as an electron donor in a TCNQ complex CrystEngComm, 2003, 5, 54 |
7204566 | CIF | C16 H36 Ag3 N S8 W2 | P 21 21 21 | 11.689; 14.482; 18.587 90; 90; 90 | 3146.4 | Zhou, Jian-Liang; Wang, Yu-Xiao; Wang, Yan; Song, Ying-Lin; Zheng, He-Gen; Li, Yi-Zhi; Yang, Lan-Ping; Xin, Xin-Quan Synthesis, crystal structure and non-linear optical properties of the heterobimetallic polymeric compound {[n-Bu4N][W2Ag3S8]}n CrystEngComm, 2003, 5, 62 |
7204570 | CIF | C27 H18 Cl N3 O2 | C m c 21 | 45.207; 6.465; 7.416 90; 90; 90 | 2167.4 | Báthori, Nikoletta; Bihátsi, László; Bombicz, Petra; Czugler, Mátyás Extremely short intermolecular N(sp2)⋯Cl contact in the bis-2,4-(biphenyl-4-yloxy)-6-chloro-[1,3,5]triazine crystal CrystEngComm, 2003, 5, 42 |
7204571 | CIF | C21 H23 Cl N4 O5 | P 1 21/n 1 | 6.545; 28.28; 11.633 90; 103.37; 90 | 2095 | Baskar Raj, S.; Muthiah, P. T.; Rychlewska, U.; Warzajtis, B. Pseudo-polymorphism and crystal engineering: hydrogen-bonded supramolecular networks in trimethoprim m-chlorobenzoate and trimethoprim m-chlorobenzoate dihydrate CrystEngComm, 2003, 5, 48 |
7204572 | CIF | C21 H25.4 Cl N4 O6.2 | P -1 | 7.271; 9.144; 16.674 86.93; 80.92; 85.43 | 1090.3 | Baskar Raj, S.; Muthiah, P. T.; Rychlewska, U.; Warzajtis, B. Pseudo-polymorphism and crystal engineering: hydrogen-bonded supramolecular networks in trimethoprim m-chlorobenzoate and trimethoprim m-chlorobenzoate dihydrate CrystEngComm, 2003, 5, 48 |
7204573 | CIF | C70 H56 O5 | P -1 | 12.9719; 15.119; 16.799 100.572; 104.897; 113.581 | 2761.4 | Guo, Fang; Guo, Wen Sheng; Toda, Fumio Supramolecular stereoisomer ‒ the conformational isomer of 1,1,6,6-tetraphenylhexa-2,4-diyne-1,6-diol in the different inclusion compounds CrystEngComm, 2003, 5, 45 |
7204574 | CIF | C25 H37.5 N O2 | P 1 21/c 1 | 13.22; 10.568; 15.517 90; 105.954; 90 | 2084.4 | Guo, Fang; Guo, Wen Sheng; Toda, Fumio Supramolecular stereoisomer ‒ the conformational isomer of 1,1,6,6-tetraphenylhexa-2,4-diyne-1,6-diol in the different inclusion compounds CrystEngComm, 2003, 5, 45 |
7204575 | CIF | C4 H6 N2 O4 | P -1 | 5.5028; 7.0583; 8.2718 70.112; 85.814; 74.095 | 290.48 | Lewis, T. C.; Tocher, D. A.; Day, G. M.; Price, S. L. A computational and experimental search for polymorphs of parabanic acid ‒ a salutary tale leading to the crystal structure of oxo-ureido-acetic acid methyl esterElectronic supplementary information (ESI) available: crystal structures of the 16 lattice energy minima in Table 2, in the space group setting used in the minimisation. See http://www.rsc.org/suppdata/ce/b2/b211784c/ CrystEngComm, 2003, 5, 3 |
7204576 | CIF | C14 H10 Cl N O2 | P 1 21/c 1 | 3.8364; 12.916; 12.221 90; 93.91; 90 | 604.2 | Kluge, S.; Dohnke, I.; Budde, F.; Hulliger, J. Polarity formation in solid solutions: (4,4'-dinitrostilbene)1 ‒ x(4-chloro-4'-nitrostilbene)x, 1 > x > 0 CrystEngComm, 2003, 5, 67 |
7204577 | CIF | C14 H10 N2 O4 | P 1 21/c 1 | 3.818; 13.0067; 12.478 90; 94.371; 90 | 617.85 | Kluge, S.; Dohnke, I.; Budde, F.; Hulliger, J. Polarity formation in solid solutions: (4,4'-dinitrostilbene)1 ‒ x(4-chloro-4'-nitrostilbene)x, 1 > x > 0 CrystEngComm, 2003, 5, 67 |
7204591 | CIF | C43 H40 N O P3 Pt | R -3 :H | 25.6343; 25.6343; 31.3646 90; 90; 120 | 17849 | Rashidi, Mehdi; Jennings, Michael C.; Puddephatt, Richard J. An organoplatinum molecular hexagon that crystallizes in a hexagonal array CrystEngComm, 2003, 5, 65 |
7204594 | CIF | C21 H26 N4 O6 S | P 1 21/n 1 | 13.407; 10.039; 17.115 90; 90.6; 90 | 2303.4 | Baskar Raj, S.; Sethuraman, V.; Francis, S.; Hemamalini, M.; Muthiah, P. Thomas; Bocelli, G.; Cantoni, A.; Rychlewska, U.; Warzajtis, B. Supramolecular organisation via hydrogen bonding in trimethoprim sulfonate salts CrystEngComm, 2003, 5, 70 |
7204595 | CIF | C20 H27 N5 O7 S | P 1 21/c 1 | 17.855; 6.136; 21.349 90; 109.08; 90 | 2210 | Baskar Raj, S.; Sethuraman, V.; Francis, S.; Hemamalini, M.; Muthiah, P. Thomas; Bocelli, G.; Cantoni, A.; Rychlewska, U.; Warzajtis, B. Supramolecular organisation via hydrogen bonding in trimethoprim sulfonate salts CrystEngComm, 2003, 5, 70 |
7204596 | CIF | C20 H26 N4 O7 S | P 1 21/c 1 | 17.507; 6.323; 21.35 90; 107.8; 90 | 2250.2 | Baskar Raj, S.; Sethuraman, V.; Francis, S.; Hemamalini, M.; Muthiah, P. Thomas; Bocelli, G.; Cantoni, A.; Rychlewska, U.; Warzajtis, B. Supramolecular organisation via hydrogen bonding in trimethoprim sulfonate salts CrystEngComm, 2003, 5, 70 |
7204597 | CIF | C21 H28 N4 O11 S | P 1 21/c 1 | 11.442; 18.769; 12.783 90; 114.18; 90 | 2504.4 | Baskar Raj, S.; Sethuraman, V.; Francis, S.; Hemamalini, M.; Muthiah, P. Thomas; Bocelli, G.; Cantoni, A.; Rychlewska, U.; Warzajtis, B. Supramolecular organisation via hydrogen bonding in trimethoprim sulfonate salts CrystEngComm, 2003, 5, 70 |
7204607 | CIF | C23 H30 O5 | P -1 | 6.2565; 10.8094; 17.2183 106.78; 93.498; 102.78 | 1077.49 | Urbanczyk-Lipkowska, Zofia; Yoshizawa, Kazuhiro; Toyota, Shinji; Toda, Fumio Easy isolation of the enol form of acetylacetone as an inclusion complex with host compounds CrystEngComm, 2003, 5, 114-116 |
7204608 | CIF | C36 H38 O6 | P 1 21 1 | 9.8539; 9.2288; 33.0868 90; 92.658; 90 | 3005.67 | Urbanczyk-Lipkowska, Zofia; Yoshizawa, Kazuhiro; Toyota, Shinji; Toda, Fumio Easy isolation of the enol form of acetylacetone as an inclusion complex with host compounds CrystEngComm, 2003, 5, 114-116 |
7204610 | CIF | C14 H11 Co F2 O6 | P n m a | 12.588; 11.726; 8.987 90; 90; 90 | 1326.5 | Braga, Dario; Maini, Lucia; Mazzotti, Michele; Rubini, Katia; Grepioni, Fabrizia Reversible gas?solid reactions between the organometallic zwitterion [CoIII(?5-C5H4COOH)(?5-C5H4COO)] and vapours of difluoro- and chloro-acetic acids CrystEngComm, 2003, 5, 154 |
7204611 | CIF | C14 H12 Co F O6 | P 1 21/n 1 | 7.833; 11.696; 14.435 90; 100.13; 90 | 1301.8 | Braga, Dario; Maini, Lucia; Mazzotti, Michele; Rubini, Katia; Grepioni, Fabrizia Reversible gas?solid reactions between the organometallic zwitterion [CoIII(?5-C5H4COOH)(?5-C5H4COO)] and vapours of difluoro- and chloro-acetic acids CrystEngComm, 2003, 5, 154 |
7204612 | CIF | C14 H12 Cl Co O6 | P 1 21/n 1 | 7.452; 12.949; 14.886 90; 102.36; 90 | 1403.1 | Braga, Dario; Maini, Lucia; Mazzotti, Michele; Rubini, Katia; Grepioni, Fabrizia Reversible gas?solid reactions between the organometallic zwitterion [CoIII(?5-C5H4COOH)(?5-C5H4COO)] and vapours of difluoro- and chloro-acetic acids CrystEngComm, 2003, 5, 154 |
7204616 | CIF | C12 H8 N6 | P 1 21/c 1 | 5.0842; 5.4202; 18.831 90; 94.126; 90 | 517.59 | Oxtoby, Neil S.; Blake, Alexander J.; Champness, Neil R.; Wilson, Claire The role of 1,2,4,5-tetrazine rings in π‒π stacking interactions CrystEngComm, 2003, 5, 82 |
7204617 | CIF | C12 H8 N6 | P 1 21/c 1 | 5.0029; 5.4035; 18.788 90; 92.776; 90 | 507.3 | Oxtoby, Neil S.; Blake, Alexander J.; Champness, Neil R.; Wilson, Claire The role of 1,2,4,5-tetrazine rings in π‒π stacking interactions CrystEngComm, 2003, 5, 82 |
7204618 | CIF | C10 H6 N8 | P 1 21/c 1 | 12.968; 5.596; 6.813 90; 92.099; 90 | 494.08 | Oxtoby, Neil S.; Blake, Alexander J.; Champness, Neil R.; Wilson, Claire The role of 1,2,4,5-tetrazine rings in π‒π stacking interactions CrystEngComm, 2003, 5, 82 |
7204619 | CIF | C18 H22 Ag Cl N0 O4 S2 | P -1 | 10.0506; 10.3341; 11.1873 66.406; 89.958; 71.145 | 996.5 | Chen, Wei; Du, Miao; Bu, Xian-He; Zhang, Ruo-Hua; Mak, Thomas C. W. Modifying silver(I) coordination frameworks containing a flexible dithioether ligand by variation of counter anions CrystEngComm, 2003, 5, 96 |
7204620 | CIF | C18 H22 Ag N O3 S2 | P 1 21/c 1 | 12.5416; 9.1826; 17.4612 90; 99.573; 90 | 1982.91 | Chen, Wei; Du, Miao; Bu, Xian-He; Zhang, Ruo-Hua; Mak, Thomas C. W. Modifying silver(I) coordination frameworks containing a flexible dithioether ligand by variation of counter anions CrystEngComm, 2003, 5, 96 |
7204621 | CIF | C18 H54 B20 N2 O19 W5 | P -1 | 11.5428; 12.485; 18.4962 97.196; 106.027; 107.916 | 2372.42 | Macías, Ramón; Kennedy, John D.; Thornton-Pett, Mark; Román, Pascual The 'globule‒globule' hybrid dicarbaborane‒polyoxometallate salt, [C2B10H11CH2NHCH(CH3)2]4[W10O32][H2O]2[(CH3)2CO]4 CrystEngComm, 2003, 5, 93 |
7204622 | CIF | C29 H32 Cl2 Fe N6 Ni O16.5 | P 1 21/n 1 | 10.1635; 19.999; 20.833 90; 103.159; 90 | 4123.3 | Kamiyama, Asako; Noguchi, Tomoko; Kajiwara, Takashi; Ito, Tasuku Controlling the construction of trinuclear, 1-D, and 2-D Ni(ii)Fe(ii)/Fe(ii)Fe(ii) complexes: selective syntheses, structures, and magnetic properties CrystEngComm, 2003, 5, 231 |
7204623 | CIF | C31 H40 Cl2 Fe N6 Ni O17 | C 1 2/c 1 | 10.4651; 18.6142; 20.3093 90; 102.868; 90 | 3856.9 | Kamiyama, Asako; Noguchi, Tomoko; Kajiwara, Takashi; Ito, Tasuku Controlling the construction of trinuclear, 1-D, and 2-D Ni(ii)Fe(ii)/Fe(ii)Fe(ii) complexes: selective syntheses, structures, and magnetic properties CrystEngComm, 2003, 5, 231 |
7204624 | CIF | C30 H35 Cl2 Fe N7 Ni O18 | C 1 2/c 1 | 10.4799; 19.5611; 20.0708 90; 103.669; 90 | 3997.9 | Kamiyama, Asako; Noguchi, Tomoko; Kajiwara, Takashi; Ito, Tasuku Controlling the construction of trinuclear, 1-D, and 2-D Ni(ii)Fe(ii)/Fe(ii)Fe(ii) complexes: selective syntheses, structures, and magnetic properties CrystEngComm, 2003, 5, 231 |
7204625 | CIF | C27 H17 Cl3 Fe N8 Ni O4 S2 | P 1 21/c 1 | 9.7081; 19.095; 18.094 90; 98.035; 90 | 3321.3 | Kamiyama, Asako; Noguchi, Tomoko; Kajiwara, Takashi; Ito, Tasuku Controlling the construction of trinuclear, 1-D, and 2-D Ni(ii)Fe(ii)/Fe(ii)Fe(ii) complexes: selective syntheses, structures, and magnetic properties CrystEngComm, 2003, 5, 231 |
7204626 | CIF | C25 H23.5 Br Cl Fe N6 Ni O10.75 | I -4 | 14.9691; 14.9691; 30.3224 90; 90; 90 | 6794.5 | Kamiyama, Asako; Noguchi, Tomoko; Kajiwara, Takashi; Ito, Tasuku Controlling the construction of trinuclear, 1-D, and 2-D Ni(ii)Fe(ii)/Fe(ii)Fe(ii) complexes: selective syntheses, structures, and magnetic properties CrystEngComm, 2003, 5, 231 |
7204627 | CIF | C79 H75 Cl19 Fe5 N18 O37 | P n n m | 32.323; 17.0606; 20.7616 90; 90; 90 | 11449 | Kamiyama, Asako; Noguchi, Tomoko; Kajiwara, Takashi; Ito, Tasuku Controlling the construction of trinuclear, 1-D, and 2-D Ni(ii)Fe(ii)/Fe(ii)Fe(ii) complexes: selective syntheses, structures, and magnetic properties CrystEngComm, 2003, 5, 231 |
7204628 | CIF | C48 H43 Cl2 Fe N12 Ni2 O20.5 | P -1 | 8.9267; 12.2683; 13.3292 90.215; 101.813; 97.288 | 1416.63 | Kamiyama, Asako; Noguchi, Tomoko; Kajiwara, Takashi; Ito, Tasuku Controlling the construction of trinuclear, 1-D, and 2-D Ni(ii)Fe(ii)/Fe(ii)Fe(ii) complexes: selective syntheses, structures, and magnetic properties CrystEngComm, 2003, 5, 231 |
7204629 | CIF | C78.5 H80.5 Cl17.5 Fe2 N18 Ni3 O39 | P n n m | 32.999; 17.1473; 20.9802 90; 90; 90 | 11871.5 | Kamiyama, Asako; Noguchi, Tomoko; Kajiwara, Takashi; Ito, Tasuku Controlling the construction of trinuclear, 1-D, and 2-D Ni(ii)Fe(ii)/Fe(ii)Fe(ii) complexes: selective syntheses, structures, and magnetic properties CrystEngComm, 2003, 5, 231 |
7204631 | CIF | C36 H36 N2 O4 | P b c a | 11.564; 16.393; 16.793 90; 90; 90 | 3183.4 | Caira, Mino R.; Jacobs, Ayesha; Nassimbeni, Luigi R.; Toda, Fumio Inclusion compounds of 1,1,6,6-tetraphenylhexa-2,4-diyne-1,6-diol with DMF and DMSO: structures, selectivity and kinetics of desolvationComplexation with diol host compounds. Part 34. For Part 33, see ref. 3. CrystEngComm, 2003, 5, 150 |
7204632 | CIF | C34 H34 O4 S2 | P b c a | 11.377; 15.982; 16.191 90; 90; 90 | 2944 | Caira, Mino R.; Jacobs, Ayesha; Nassimbeni, Luigi R.; Toda, Fumio Inclusion compounds of 1,1,6,6-tetraphenylhexa-2,4-diyne-1,6-diol with DMF and DMSO: structures, selectivity and kinetics of desolvationComplexation with diol host compounds. Part 34. For Part 33, see ref. 3. CrystEngComm, 2003, 5, 150 |
7204634 | CIF | C96 H98 N4 O62 | P 1 21/n 1 | 14.218; 41.861; 17.664 90; 106.29; 90 | 10091 | Almeida Paz, Filipe A.; Klinowski, Jacek Supramolecular architecture of a novel salt of trimesic acid and 1,2-bis(4-pyridyl)ethane CrystEngComm, 2003, 5, 238 |
7204640 | CIF | C18 H15 Cr N12 O4 S | I 41 | 12.8274; 12.8274; 14.2567 90; 90; 90 | 2345.8 | Krister Larsson; Lars Öhrström A (10,3)-b net by sulfate hydrogen-bonded biimidazolate complexes CrystEngComm, 2003, 5, 222-225 |
7204642 | CIF | C15 H13 N5 O3 | C 1 2/c 1 | 26.361; 6.777; 15.553 90; 95.44; 90 | 2766 | Barnett, Sarah A.; Blake, Alexander J.; Champness, Neil R. Polymorphism in hydrogen bonded frameworks; cyanuric acid‒bis(4-pyridyl)ethene adducts CrystEngComm, 2003, 5, 134 |
7204643 | CIF | C15 H13 N5 O3 | C 1 2/c 1 | 19.174; 6.7825; 32.748 90; 91.246; 90 | 4257.8 | Barnett, Sarah A.; Blake, Alexander J.; Champness, Neil R. Polymorphism in hydrogen bonded frameworks; cyanuric acid‒bis(4-pyridyl)ethene adducts CrystEngComm, 2003, 5, 134 |
7204644 | CIF | C190.5 H98.02 N10.66 Zn2 | P -1 | 13.3658; 19.5386; 24.7121 85.67; 84.58; 88.38 | 6404.9 | Litvinov, Aleksey L.; Konarev, Dmitri V.; Kovalevsky, Andrey Yu.; Coppens, Philip; Lyubovskaya, Rimma N. Synthesis and crystal structure of a new supramolecular complex: [(ZnTPP)2Prz]�C60�5.34C7H8�0.66C6H5CNElectronic supplementary information (ESI) available: charaterisation for compound 1. See http://www.rsc.org/suppdata/ce/b3/b303415a/ CrystEngComm, 2003, 5, 137 |
7204645 | CIF | C44 H24 Br2 O2 | P -1 | 9.142; 9.6756; 19.9513 79.184; 83.998; 68.436 | 1610.88 | Tanaka, Koichi; Tomomori, Akihiro; Scott, Janet L. Novel photochromism of propargylallene in the solid state CrystEngComm, 2003, 5, 147 |
7204646 | CIF | C45 H25 Br2 Cl3 O2 | P -1 | 9.5423; 9.8723; 20.2727 83.159; 87.31; 76.521 | 1843.59 | Tanaka, Koichi; Tomomori, Akihiro; Scott, Janet L. Novel photochromism of propargylallene in the solid state CrystEngComm, 2003, 5, 147 |
7204650 | CIF | C4 H26 Fe N2 O14 P2 | P 1 21/c 1 | 6.317; 9.643; 12.877 90; 92.574; 90 | 783.6 | Abu-Shandi, Khalid; Winkler, Heiner; Wu, Biao; Janiak, Christoph Open-framework iron phosphates: Syntheses, structures, sorption studies and oxidation catalysisThis article is based (partly) on a presentation which will be made at the European Research Conference (EURESCO) on "Molecular Crystal Engineering - EuroConference on Design and Preparation of Molecular Materials" (Acquafredda di Maratea, Italy, 31 May - 5 June 2003) organised by the European Science Foundation and supported by the European Commission, Research DG, Human Potential Programme, High-Level Scientific Conferences, Contract HPCF-CT-2002-00270. This information is the sole responsibility of the author(s) and does not reflect the ESF or Community's opinion. The ESF and the Community are not responsible for any use that might be made of data appearing in this publication. CrystEngComm, 2003, 5, 180 |
7204651 | CIF | Fe2 H9 N O11 P2 | P 1 21/n 1 | 9.815; 9.7225; 9.877 90; 102.87; 90 | 918.8 | Abu-Shandi, Khalid; Winkler, Heiner; Wu, Biao; Janiak, Christoph Open-framework iron phosphates: Syntheses, structures, sorption studies and oxidation catalysisThis article is based (partly) on a presentation which will be made at the European Research Conference (EURESCO) on "Molecular Crystal Engineering - EuroConference on Design and Preparation of Molecular Materials" (Acquafredda di Maratea, Italy, 31 May - 5 June 2003) organised by the European Science Foundation and supported by the European Commission, Research DG, Human Potential Programme, High-Level Scientific Conferences, Contract HPCF-CT-2002-00270. This information is the sole responsibility of the author(s) and does not reflect the ESF or Community's opinion. The ESF and the Community are not responsible for any use that might be made of data appearing in this publication. CrystEngComm, 2003, 5, 180 |
7204652 | CIF | C4 H13 Fe3 N2 O17.25 P4 | P -1 | 6.3554; 9.166; 15.311 90.27; 91.338; 106.594 | 854.5 | Abu-Shandi, Khalid; Winkler, Heiner; Wu, Biao; Janiak, Christoph Open-framework iron phosphates: Syntheses, structures, sorption studies and oxidation catalysisThis article is based (partly) on a presentation which will be made at the European Research Conference (EURESCO) on "Molecular Crystal Engineering - EuroConference on Design and Preparation of Molecular Materials" (Acquafredda di Maratea, Italy, 31 May - 5 June 2003) organised by the European Science Foundation and supported by the European Commission, Research DG, Human Potential Programme, High-Level Scientific Conferences, Contract HPCF-CT-2002-00270. This information is the sole responsibility of the author(s) and does not reflect the ESF or Community's opinion. The ESF and the Community are not responsible for any use that might be made of data appearing in this publication. CrystEngComm, 2003, 5, 180 |
7204659 | CIF | C46 H104 N14 O6 S6 | P -1 | 8.4989; 10.4456; 19.6071 102.094; 95.528; 99.56 | 1662.78 | Babb, Jennifer E. V.; Burke, Nichola J.; Burrows, Andrew D.; Mahon, Mary F.; Slade, David M. K. Hydrogen-bonded linear thiourea hexads in tetra-n-butylammonium terephthalate inclusion compounds CrystEngComm, 2003, 5, 226 |
7204660 | CIF | C42 H86.66667 N6 O5.33333 S2 | P -1 | 8.581; 16.348; 27.262 103.653; 92.683; 101.473 | 3624.36 | Babb, Jennifer E. V.; Burke, Nichola J.; Burrows, Andrew D.; Mahon, Mary F.; Slade, David M. K. Hydrogen-bonded linear thiourea hexads in tetra-n-butylammonium terephthalate inclusion compounds CrystEngComm, 2003, 5, 226 |
7204661 | CIF | C18 H44 Br N5 S2 | P b c a | 16.788; 17.06; 18.313 90; 90; 90 | 5244.9 | Babb, Jennifer E. V.; Burke, Nichola J.; Burrows, Andrew D.; Mahon, Mary F.; Slade, David M. K. Hydrogen-bonded linear thiourea hexads in tetra-n-butylammonium terephthalate inclusion compounds CrystEngComm, 2003, 5, 226 |
7204662 | CIF | C13 H12 N2 O4 | P 1 21/n 1 | 6.0729; 9.4013; 20.6723 90; 95.287; 90 | 1175.23 | Vishweshwar, Peddy; Nangia, Ashwini; Lynch, Vincent M. Supramolecular synthons in phenol?isonicotinamide adducts CrystEngComm, 2003, 5, 164 |
7204663 | CIF | C18 H18 N4 O4 | P -1 | 7.0307; 10.7052; 11.9562 87.755; 82.735; 73.835 | 857.36 | Vishweshwar, Peddy; Nangia, Ashwini; Lynch, Vincent M. Supramolecular synthons in phenol?isonicotinamide adducts CrystEngComm, 2003, 5, 164 |
7204664 | CIF | C18 H22 N4 O7 | P -1 | 7.4967; 8.8748; 15.2793 95.1886; 97.479; 105.77 | 961.5 | Vishweshwar, Peddy; Nangia, Ashwini; Lynch, Vincent M. Supramolecular synthons in phenol?isonicotinamide adducts CrystEngComm, 2003, 5, 164 |
7204665 | CIF | C9 H9 N2 O2 | P 1 21/c 1 | 14.2811; 5.4136; 11.911 90; 111.934; 90 | 854.21 | Vishweshwar, Peddy; Nangia, Ashwini; Lynch, Vincent M. Supramolecular synthons in phenol?isonicotinamide adducts CrystEngComm, 2003, 5, 164 |
7204666 | CIF | C26 H28 Fe N4 O4 S | C 1 2/c 1 | 21.731; 10.588; 11.685 90; 110.5; 90 | 2518.3 | Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.; Rizzato, Silvia New architectures from the self-assembly of MIISO4 salts with bis(4-pyridyl) ligands. The first case of polycatenation involving three distinct sets of 2D polymeric (4,4)-layers parallel to a common axis CrystEngComm, 2003, 5, 190 |
7204667 | CIF | C12 H8 Cd N2 O4 S | P -4 21 m | 6.8307; 6.8307; 14.404 90; 90; 90 | 672.07 | Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.; Rizzato, Silvia New architectures from the self-assembly of MIISO4 salts with bis(4-pyridyl) ligands. The first case of polycatenation involving three distinct sets of 2D polymeric (4,4)-layers parallel to a common axis CrystEngComm, 2003, 5, 190 |
7204668 | CIF | C12 H18 Cu N2 O7 S | P -1 | 9.399; 9.496; 10.073 62.11; 89.18; 73 | 751.9 | Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.; Rizzato, Silvia New architectures from the self-assembly of MIISO4 salts with bis(4-pyridyl) ligands. The first case of polycatenation involving three distinct sets of 2D polymeric (4,4)-layers parallel to a common axis CrystEngComm, 2003, 5, 190 |
7204669 | CIF | C38 H44 Co2 N6 O10 S2 | C 1 2/c 1 | 23.35; 19.882; 13.644 90; 106.29; 90 | 6080 | Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.; Rizzato, Silvia New architectures from the self-assembly of MIISO4 salts with bis(4-pyridyl) ligands. The first case of polycatenation involving three distinct sets of 2D polymeric (4,4)-layers parallel to a common axis CrystEngComm, 2003, 5, 190 |
7204670 | CIF | C120 H152 N20 Ni6 O40 S6 | P 1 21/c 1 | 21.485; 27.235; 26.925 90; 90.24; 90 | 15755 | Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.; Rizzato, Silvia New architectures from the self-assembly of MIISO4 salts with bis(4-pyridyl) ligands. The first case of polycatenation involving three distinct sets of 2D polymeric (4,4)-layers parallel to a common axis CrystEngComm, 2003, 5, 190 |
7204675 | CIF | C14 H18 Fe O2 | P 1 21/c 1 | 15.2583; 9.7626; 8.294 90; 97.46; 90 | 1225.02 | Michael Schmittel; Mukul Lal; Marc Schlosser; Hans-Jörg Deiseroth Unusual ladder-like supramolecular arrangement by cooperative effect of bifurcated O‒HO hydrogen bonding in crystals of racemic 4-ferrocenylbutan-1,2-diol CrystEngComm, 2003, 5, 294-299 |
7204676 | CIF | C46.5 H36 Cl3.5 N5 O3 | P -1 | 8.06; 15.039; 16.817 83.761; 77.324; 88.522 | 1976.99 | Vinodu, Mikki; Goldberg, Israel New assembly modes of porphyrin-based networks CrystEngComm, 2003, 5, 204 |
7204677 | CIF | C5 H8 Li N O4 | P 1 | 5.2961; 7.8521; 7.9506 90.03; 106.037; 95.972 | 315.89 | Wiesbrock, Frank; Schmidbaur, Hubert Lithium l-hydrogen-?-glutamate: A layer structure with asymmetrical tunnels formed by nets with two different macrocycles CrystEngComm, 2003, 5, 262 |
7204678 | CIF | C8 H7 N | P n m a | 10.423; 7.033; 8.951 90; 90; 90 | 656.2 | Dey, Archan; Jetti, Ram K. R.; Boese, Roland; Desiraju, Gautam R. Supramolecular equivalence of halogen, ethynyl and hydroxy groups. A comparison of the crystal structures of some 4-substituted anilines CrystEngComm, 2003, 5, 248 |
7204679 | CIF | C6 H5 Br N | P n m a | 8.594; 7.6166; 9.469 90; 90; 90 | 619.8 | Dey, Archan; Jetti, Ram K. R.; Boese, Roland; Desiraju, Gautam R. Supramolecular equivalence of halogen, ethynyl and hydroxy groups. A comparison of the crystal structures of some 4-substituted anilines CrystEngComm, 2003, 5, 248 |
7204680 | CIF | C6 H6 I N | P 1 21 1 | 8.422; 4.965; 8.645 90; 109.79; 90 | 340.1 | Dey, Archan; Jetti, Ram K. R.; Boese, Roland; Desiraju, Gautam R. Supramolecular equivalence of halogen, ethynyl and hydroxy groups. A comparison of the crystal structures of some 4-substituted anilines CrystEngComm, 2003, 5, 248 |
7204682 | CIF | C5 H6 Co N O5 | P 1 21/n 1 | 6.961; 14.442; 7.434 90; 92.02; 90 | 746.9 | Fernando S. Delgado; Joaquín Sanchiz; Catalina Ruiz-Pérez; Francesc Lloret; Miguel Julve High-dimensional malonate-based materials: Synthesis, crystal structures and magnetic properties of [M2(mal)2(L)(H2O)2]n·n(H2O) M = Zn(II), Co(II); H2mal = malonic acid, L = pyrimidine, pyrazine CrystEngComm, 2003, 5, 280-284 |
7204683 | CIF | C5 H6 N O5 Zn | P 1 21/n 1 | 6.9461; 14.269; 7.432 90; 92.232; 90 | 736.1 | Fernando S. Delgado; Joaquín Sanchiz; Catalina Ruiz-Pérez; Francesc Lloret; Miguel Julve High-dimensional malonate-based materials: Synthesis, crystal structures and magnetic properties of [M2(mal)2(L)(H2O)2]n·n(H2O) M = Zn(II), Co(II); H2mal = malonic acid, L = pyrimidine, pyrazine CrystEngComm, 2003, 5, 280-284 |
7204684 | CIF | C5 H6 Co N O5 | C 1 2 1 | 16.802; 6.8884; 7.4787 90; 115.119; 90 | 783.72 | Fernando S. Delgado; Joaquín Sanchiz; Catalina Ruiz-Pérez; Francesc Lloret; Miguel Julve High-dimensional malonate-based materials: Synthesis, crystal structures and magnetic properties of [M2(mal)2(L)(H2O)2]n·n(H2O) M = Zn(II), Co(II); H2mal = malonic acid, L = pyrimidine, pyrazine CrystEngComm, 2003, 5, 280-284 |
7204685 | CIF | C5 H6 N O5 Zn | C 1 2 1 | 16.546; 6.929; 7.4783 90; 113.472; 90 | 786.42 | Fernando S. Delgado; Joaquín Sanchiz; Catalina Ruiz-Pérez; Francesc Lloret; Miguel Julve High-dimensional malonate-based materials: Synthesis, crystal structures and magnetic properties of [M2(mal)2(L)(H2O)2]n·n(H2O) M = Zn(II), Co(II); H2mal = malonic acid, L = pyrimidine, pyrazine CrystEngComm, 2003, 5, 280-284 |
7204686 | CIF | C7 H11 Hg N S2 | P 1 21/n 1 | 7.481; 12.2434; 10.8863 90; 108.526; 90 | 945.44 | Sing Lai, Chian; Tiekink, Edward R. T. Supramolecular association in organomercury(ii) 1,1-dithiolates. Complementarity between Hg?S and hydrogen bonding interactions in organomercury(ii) 2-amino-cyclopent-1-ene-1-carbodithioates CrystEngComm, 2003, 5, 253 |
7204687 | CIF | C7 H11 Hg N S2 | P 1 21/c 1 | 12.3186; 12.7707; 12.3438 90; 91.394; 90 | 1941.3 | Sing Lai, Chian; Tiekink, Edward R. T. Supramolecular association in organomercury(ii) 1,1-dithiolates. Complementarity between Hg?S and hydrogen bonding interactions in organomercury(ii) 2-amino-cyclopent-1-ene-1-carbodithioates CrystEngComm, 2003, 5, 253 |
7204688 | CIF | C12 H13 Hg N S2 | P b c a | 11.1294; 8.9365; 25.7799 90; 90; 90 | 2564 | Sing Lai, Chian; Tiekink, Edward R. T. Supramolecular association in organomercury(ii) 1,1-dithiolates. Complementarity between Hg?S and hydrogen bonding interactions in organomercury(ii) 2-amino-cyclopent-1-ene-1-carbodithioates CrystEngComm, 2003, 5, 253 |
7204690 | CIF | C6 H30 N15 P3 | P 1 21/n 1 | 8.6181; 15.486; 13.996 90; 93.97; 90 | 1863.4 | Chandrasekhar, Vadapalli; Krishnan, Venkatasubbaiah; Thangavelu Senthil Andavan, Gurusamy; Steiner, Alexander; Zacchini, Stefano Cyclophosphazene supramolecular assemblies: N?H?N and C?H?N mediated supramolecular networks in the crystal structures of N3P3[N(Me)NH2]6 and spiro-N3P3[O2C12H8][N(Me)NH2]4 CrystEngComm, 2003, 5, 245 |
7204691 | CIF | C16 H28 N11 O2 P3 | P 1 21/c 1 | 17.227; 31.187; 8.3154 90; 90.91; 90 | 4467 | Chandrasekhar, Vadapalli; Krishnan, Venkatasubbaiah; Thangavelu Senthil Andavan, Gurusamy; Steiner, Alexander; Zacchini, Stefano Cyclophosphazene supramolecular assemblies: N?H?N and C?H?N mediated supramolecular networks in the crystal structures of N3P3[N(Me)NH2]6 and spiro-N3P3[O2C12H8][N(Me)NH2]4 CrystEngComm, 2003, 5, 245 |
7204692 | CIF | C22 H34 I6 N2 Pd2 | P -1 | 8.5038; 8.8887; 11.5366 93.953; 107.892; 92.848 | 825.57 | Neve, Francesco; Crispini, Alessandra N,N?-Dodecamethylene-bis(pyridinium) goes lamellar. Role of C?H?I, C?H?M, and I?I interactions in the crystal structure of its hexaiododipalladate(II) derivativeElectronic supplementary information (ESI) available: Figure S1, Table S1. See http://www.rsc.org/suppdata/ce/b3/b305804b/ CrystEngComm, 2003, 5, 265 |
7204697 | CIF | C40 H33 Fe Hg I4 N7 O | P b c a | 16.248; 19.603; 26.44 90; 90; 90 | 8421 | Maharaj, Felicia; Russell, Vanessa; Chow, Hong; Page, Michael; Scudder, Marcia; Craig, Don; Dance, Ian Polymorphs and pseudo-polymorphs: nine crystals containing [Fe(phen)3]2+ associated with [HgI4]2? CrystEngComm, 2003, 5, 285 |
7204698 | CIF | C39 H32 Fe Hg I4 N6 O2 | P -1 | 11.2; 13.028; 14.62 87.378; 75.441; 83.887 | 2052.6 | Maharaj, Felicia; Russell, Vanessa; Chow, Hong; Page, Michael; Scudder, Marcia; Craig, Don; Dance, Ian Polymorphs and pseudo-polymorphs: nine crystals containing [Fe(phen)3]2+ associated with [HgI4]2? CrystEngComm, 2003, 5, 285 |
7204699 | CIF | C39 H32 Fe Hg I4 N6 O2 | P -1 | 11.384; 12.659; 14.885 89.37; 73.79; 84.19 | 2048.9 | Maharaj, Felicia; Russell, Vanessa; Chow, Hong; Page, Michael; Scudder, Marcia; Craig, Don; Dance, Ian Polymorphs and pseudo-polymorphs: nine crystals containing [Fe(phen)3]2+ associated with [HgI4]2? CrystEngComm, 2003, 5, 285 |
7204700 | CIF | C42 H38 Fe Hg I4 N8 O2 | P -1 | 11.585; 12.543; 17.013 70.16; 76.87; 84.26 | 2264 | Maharaj, Felicia; Russell, Vanessa; Chow, Hong; Page, Michael; Scudder, Marcia; Craig, Don; Dance, Ian Polymorphs and pseudo-polymorphs: nine crystals containing [Fe(phen)3]2+ associated with [HgI4]2? CrystEngComm, 2003, 5, 285 |
7204701 | CIF | C39 H30 Fe Hg I4 N6 O | P 1 | 9.709; 9.885; 10.814 76.06; 83.63; 87.07 | 1000.8 | Maharaj, Felicia; Russell, Vanessa; Chow, Hong; Page, Michael; Scudder, Marcia; Craig, Don; Dance, Ian Polymorphs and pseudo-polymorphs: nine crystals containing [Fe(phen)3]2+ associated with [HgI4]2? CrystEngComm, 2003, 5, 285 |
7204702 | CIF | C36 H27 Fe Hg I4 N6 O1.5 | P 1 21/c 1 | 10.18; 17.079; 23.62 90; 97.22; 90 | 4074 | Maharaj, Felicia; Russell, Vanessa; Chow, Hong; Page, Michael; Scudder, Marcia; Craig, Don; Dance, Ian Polymorphs and pseudo-polymorphs: nine crystals containing [Fe(phen)3]2+ associated with [HgI4]2? CrystEngComm, 2003, 5, 285 |
7204703 | CIF | C42 H38 Fe Hg I4 N8 O2 | P 1 21/c 1 | 19.18; 19.465; 13.492 90; 109.44; 90 | 4750 | Maharaj, Felicia; Russell, Vanessa; Chow, Hong; Page, Michael; Scudder, Marcia; Craig, Don; Dance, Ian Polymorphs and pseudo-polymorphs: nine crystals containing [Fe(phen)3]2+ associated with [HgI4]2? CrystEngComm, 2003, 5, 285 |
7204704 | CIF | C38 H32 Fe Hg I4 N6 O2 S | P -1 | 11.442; 12.816; 14.937 82.22; 81.78; 82.97 | 2136 | Maharaj, Felicia; Russell, Vanessa; Chow, Hong; Page, Michael; Scudder, Marcia; Craig, Don; Dance, Ian Polymorphs and pseudo-polymorphs: nine crystals containing [Fe(phen)3]2+ associated with [HgI4]2? CrystEngComm, 2003, 5, 285 |
7204705 | CIF | C18 H40 La2 O32 | P -3 | 10.3426; 10.3426; 8.9709 90; 90; 120 | 831 | Abrahams, Brendan F.; Moylan, Michael; Orchard, Simon D.; Robson, Richard Channel-containing lanthanide mucate structuresElectronic Supplementary Information (ESI) available: Figures 1S?5S. See http://www.rsc.org/suppdata/ce/b3/b306838b/ CrystEngComm, 2003, 5, 313 |
7204706 | CIF | C18 H40 Ce2 O32 | P -3 | 10.288; 10.288; 8.9427 90; 90; 120 | 819.7 | Abrahams, Brendan F.; Moylan, Michael; Orchard, Simon D.; Robson, Richard Channel-containing lanthanide mucate structuresElectronic Supplementary Information (ESI) available: Figures 1S?5S. See http://www.rsc.org/suppdata/ce/b3/b306838b/ CrystEngComm, 2003, 5, 313 |
7204707 | CIF | C18 H40 O32 Pr2 | P -3 | 10.2182; 10.2182; 8.9084 90; 90; 120 | 805.5 | Abrahams, Brendan F.; Moylan, Michael; Orchard, Simon D.; Robson, Richard Channel-containing lanthanide mucate structuresElectronic Supplementary Information (ESI) available: Figures 1S?5S. See http://www.rsc.org/suppdata/ce/b3/b306838b/ CrystEngComm, 2003, 5, 313 |
7204708 | CIF | C18 H40 Nd2 O32 | P -3 | 10.2151; 10.2151; 8.9021 90; 90; 120 | 804.5 | Abrahams, Brendan F.; Moylan, Michael; Orchard, Simon D.; Robson, Richard Channel-containing lanthanide mucate structuresElectronic Supplementary Information (ESI) available: Figures 1S?5S. See http://www.rsc.org/suppdata/ce/b3/b306838b/ CrystEngComm, 2003, 5, 313 |
7204709 | CIF | C18 H52 Nd2 O38 | P b c a | 10.8647; 19.681; 19.974 90; 90; 90 | 4271 | Abrahams, Brendan F.; Moylan, Michael; Orchard, Simon D.; Robson, Richard Channel-containing lanthanide mucate structuresElectronic Supplementary Information (ESI) available: Figures 1S?5S. See http://www.rsc.org/suppdata/ce/b3/b306838b/ CrystEngComm, 2003, 5, 313 |
7204710 | CIF | C18 H52 Eu2 O38 | P b c a | 10.761; 19.427; 19.681 90; 90; 90 | 4114 | Abrahams, Brendan F.; Moylan, Michael; Orchard, Simon D.; Robson, Richard Channel-containing lanthanide mucate structuresElectronic Supplementary Information (ESI) available: Figures 1S?5S. See http://www.rsc.org/suppdata/ce/b3/b306838b/ CrystEngComm, 2003, 5, 313 |
7204715 | CIF | C24 H18 Fe2 | P 1 21/c 1 | 11.049; 9.568; 8.767 90; 102.35; 90 | 905.4 | Maharaj, Felicia; McDonagh, Andrew; Scudder, Marcia; Craig, Don; Dance, Ian Crystal packing principles for ferrocenyl groups linked by polyyne chains: dimorphism of Fc-C4-Fc CrystEngComm, 2003, 5, 305 |
7204716 | CIF | C55 H52 N2 O8 | P -1 | 13.1315; 14.2151; 14.6358 109.428; 112.98; 97.464 | 2263.3 | Nakamura, A.; Sato, T.; Kuroda, R. Novel layered structures of the crystals based on C-methylcalix[4]resorcinarene formed at high temperatureElectronic supplementary information (ESI) available: Structures of compounds 8, 9, 10 and 12 (4 figures). See http://www.rsc.org/suppdata/ce/b3/b307471d/ CrystEngComm, 2003, 5, 318 |
7204717 | CIF | C62 H60 N2 O8 | P 1 21/n 1 | 17.4271; 13.5493; 21.605 90; 95.172; 90 | 5080.7 | Nakamura, A.; Sato, T.; Kuroda, R. Novel layered structures of the crystals based on C-methylcalix[4]resorcinarene formed at high temperatureElectronic supplementary information (ESI) available: Structures of compounds 8, 9, 10 and 12 (4 figures). See http://www.rsc.org/suppdata/ce/b3/b307471d/ CrystEngComm, 2003, 5, 318 |
7204718 | CIF | C52 H56 N2 O9 | P -1 | 11.5406; 14.0385; 15.682 71.78; 75.01; 65.873 | 2177.2 | Nakamura, A.; Sato, T.; Kuroda, R. Novel layered structures of the crystals based on C-methylcalix[4]resorcinarene formed at high temperatureElectronic supplementary information (ESI) available: Structures of compounds 8, 9, 10 and 12 (4 figures). See http://www.rsc.org/suppdata/ce/b3/b307471d/ CrystEngComm, 2003, 5, 318 |
7204719 | CIF | C63 H66 N4 O9 | P 1 21/c 1 | 20.7807; 16.339; 15.4817 90; 98.073; 90 | 5204.5 | Nakamura, A.; Sato, T.; Kuroda, R. Novel layered structures of the crystals based on C-methylcalix[4]resorcinarene formed at high temperatureElectronic supplementary information (ESI) available: Structures of compounds 8, 9, 10 and 12 (4 figures). See http://www.rsc.org/suppdata/ce/b3/b307471d/ CrystEngComm, 2003, 5, 318 |
7204720 | CIF | C33 H34 N2 O4.5 | P b c n | 15.9821; 14.3963; 23.765 90; 90; 90 | 5467.9 | Nakamura, A.; Sato, T.; Kuroda, R. Novel layered structures of the crystals based on C-methylcalix[4]resorcinarene formed at high temperatureElectronic supplementary information (ESI) available: Structures of compounds 8, 9, 10 and 12 (4 figures). See http://www.rsc.org/suppdata/ce/b3/b307471d/ CrystEngComm, 2003, 5, 318 |
7204721 | CIF | C65 H64 N4 O8 | P -1 | 11.7903; 14.9265; 15.6196 94.159; 92.529; 100.758 | 2688.8 | Nakamura, A.; Sato, T.; Kuroda, R. Novel layered structures of the crystals based on C-methylcalix[4]resorcinarene formed at high temperatureElectronic supplementary information (ESI) available: Structures of compounds 8, 9, 10 and 12 (4 figures). See http://www.rsc.org/suppdata/ce/b3/b307471d/ CrystEngComm, 2003, 5, 318 |
7204722 | CIF | C62 H50 N3 O8 | P -1 | 10.3752; 12.2621; 20.1337 95.181; 103.948; 94.166 | 2463.9 | Nakamura, A.; Sato, T.; Kuroda, R. Novel layered structures of the crystals based on C-methylcalix[4]resorcinarene formed at high temperatureElectronic supplementary information (ESI) available: Structures of compounds 8, 9, 10 and 12 (4 figures). See http://www.rsc.org/suppdata/ce/b3/b307471d/ CrystEngComm, 2003, 5, 318 |
7204723 | CIF | C42.75 H41.25 N2 O5.25 | P 1 21/m 1 | 11.1453; 24.728; 13.097 90; 102.415; 90 | 3525.1 | Nakamura, A.; Sato, T.; Kuroda, R. Novel layered structures of the crystals based on C-methylcalix[4]resorcinarene formed at high temperatureElectronic supplementary information (ESI) available: Structures of compounds 8, 9, 10 and 12 (4 figures). See http://www.rsc.org/suppdata/ce/b3/b307471d/ CrystEngComm, 2003, 5, 318 |
7204729 | CIF | C6 H5 Cl2 N O | P m n b | 6.358; 8.744; 13.594 90; 90; 90 | 755.7 | Kalle I. Nättinen; Kari Rissanen Chloride‒hydrogen interactions of picolinic, nicotinic and isonicotinic acid chloride hydrochlorides in the crystalline state CrystEngComm, 2003, 5, 326-330 |
7204730 | CIF | C6 H5 Cl2 N O | P 1 21/n 1 | 7.2695; 4.9453; 20.2207 90; 95.99; 90 | 722.96 | Kalle I. Nättinen; Kari Rissanen Chloride‒hydrogen interactions of picolinic, nicotinic and isonicotinic acid chloride hydrochlorides in the crystalline state CrystEngComm, 2003, 5, 326-330 |
7204731 | CIF | C6 H5 Cl2 N O | P 1 21/n 1 | 7.223; 4.962; 20.324 90; 97.06; 90 | 722.9 | Kalle I. Nättinen; Kari Rissanen Chloride‒hydrogen interactions of picolinic, nicotinic and isonicotinic acid chloride hydrochlorides in the crystalline state CrystEngComm, 2003, 5, 326-330 |
7204732 | CIF | C5 H9 N O2 S2 | P 1 21/c 1 | 11.8327; 7.6628; 14.1769 90; 138.21; 90 | 856.62 | Wheeler, Kraig A.; Harrington, Beverly; Zapp, Matthew; Casey, Endia Competitive N?H?O?C and N?H?S?C hydrogen bonding in alanine dithiocarbamates CrystEngComm, 2003, 5, 337 |
7204733 | CIF | C6 H11 N O2 S2 | P 1 21/c 1 | 8.8922; 7.4758; 14.305 90; 99.742; 90 | 937.2 | Wheeler, Kraig A.; Harrington, Beverly; Zapp, Matthew; Casey, Endia Competitive N?H?O?C and N?H?S?C hydrogen bonding in alanine dithiocarbamates CrystEngComm, 2003, 5, 337 |
7204734 | CIF | C7 H13 N O2 S2 | P 1 21/c 1 | 13.198; 7.613; 11.927 90; 116.71; 90 | 1070.5 | Wheeler, Kraig A.; Harrington, Beverly; Zapp, Matthew; Casey, Endia Competitive N?H?O?C and N?H?S?C hydrogen bonding in alanine dithiocarbamates CrystEngComm, 2003, 5, 337 |
7204735 | CIF | C11 H13 N O2 S2 | P 1 21/c 1 | 14.046; 10.84; 8.852 90; 107.97; 90 | 1282 | Wheeler, Kraig A.; Harrington, Beverly; Zapp, Matthew; Casey, Endia Competitive N?H?O?C and N?H?S?C hydrogen bonding in alanine dithiocarbamates CrystEngComm, 2003, 5, 337 |
7204740 | CIF | C6 H7 Br2 N | P 1 21/c 1 | 7.9431; 13.2946; 7.6992 90; 104.125; 90 | 788.46 | Jones, Peter G.; Vancea, Fabiola Unexpected isostructurality by permutation of classical and ?weak? hydrogen bonds CrystEngComm, 2003, 5, 303 |
7204741 | CIF | C10 H10 Cl6 Co N2 | P -1 | 6.7526; 8.1793; 14.806 92.114; 93.148; 99.358 | 804.8 | Lee Brammer; Guillermo Mínguez Espallargas; Harry Adams Involving metals in halogen‒halogen interactions: second-sphere Lewis acid ligands for perhalometallate ions (M‒XX'‒C) CrystEngComm, 2003, 5, 343-345 |
7204742 | CIF | C10 H10 Br2 Cl4 Co N2 | P -1 | 6.8163; 8.9754; 13.7869 86.386; 85.454; 86.873 | 838.1 | Lee Brammer; Guillermo Mínguez Espallargas; Harry Adams Involving metals in halogen‒halogen interactions: second-sphere Lewis acid ligands for perhalometallate ions (M‒XX'‒C) CrystEngComm, 2003, 5, 343-345 |
7204743 | CIF | C10 H10 Cl4 Co I2 N2 | P 1 21/c 1 | 6.983; 16.1749; 15.7849 90; 96.306; 90 | 1772.1 | Lee Brammer; Guillermo Mínguez Espallargas; Harry Adams Involving metals in halogen‒halogen interactions: second-sphere Lewis acid ligands for perhalometallate ions (M‒XX'‒C) CrystEngComm, 2003, 5, 343-345 |
7204766 | CIF | C16 H28 O4 | P 1 21/c 1 | 7.198; 12.957; 18.653 90; 111.69; 90 | 1616.5 | Alshahateet, Solhe F.; Nakano, Kazunori; Bishop, Roger; Craig, Donald C.; Harris, Kenneth D. M.; Scudder, Marcia L. Co-crystalline hydrogen bonded solids based on the alcohol?carboxylic acid?alcohol supramolecular motif CrystEngComm, 2004, 6, 5 |
7204767 | CIF | C20 H28 O4 | C 1 2/c 1 | 10.596; 9.766; 35.351 90; 94.96; 90 | 3644 | Alshahateet, Solhe F.; Nakano, Kazunori; Bishop, Roger; Craig, Donald C.; Harris, Kenneth D. M.; Scudder, Marcia L. Co-crystalline hydrogen bonded solids based on the alcohol?carboxylic acid?alcohol supramolecular motif CrystEngComm, 2004, 6, 5 |
7204768 | CIF | C16 H30 O3 | P 1 21/c 1 | 6.89; 13.261; 18.879 90; 102.58; 90 | 1683.5 | Alshahateet, Solhe F.; Nakano, Kazunori; Bishop, Roger; Craig, Donald C.; Harris, Kenneth D. M.; Scudder, Marcia L. Co-crystalline hydrogen bonded solids based on the alcohol?carboxylic acid?alcohol supramolecular motif CrystEngComm, 2004, 6, 5 |
7204777 | CIF | C35 H26 F2 O3 | P -1 | 8.7846; 12.3272; 13.4594 70.08; 76.153; 83.096 | 1329.29 | Tanaka, Koichi; Yamamoto, Yohei; Caira, Mino R. Guest-dependent photochromism of 3,3?-bis-(4-fluoro-phenyl)-3H,3?H- [2,2?]biindenylidene-1,1?-dione in its inclusion crystals CrystEngComm, 2004, 6, 1 |
7204778 | CIF | C31 H20 Cl2 F2 O2 | P 1 21/n 1 | 9.0486; 19.3364; 14.4056 90; 95.365; 90 | 2509.47 | Tanaka, Koichi; Yamamoto, Yohei; Caira, Mino R. Guest-dependent photochromism of 3,3?-bis-(4-fluoro-phenyl)-3H,3?H- [2,2?]biindenylidene-1,1?-dione in its inclusion crystals CrystEngComm, 2004, 6, 1 |
7204779 | CIF | C30 H18 F2 O2 | P -1 | 12.8638; 15.8214; 16.1334 88.14; 88.037; 84.747 | 3266.4 | Tanaka, Koichi; Yamamoto, Yohei; Caira, Mino R. Guest-dependent photochromism of 3,3?-bis-(4-fluoro-phenyl)-3H,3?H- [2,2?]biindenylidene-1,1?-dione in its inclusion crystals CrystEngComm, 2004, 6, 1 |
7204786 | CIF | C42 H33 Ag3 Cr3 N9 O27 | P -1 | 9.486; 11.381; 23.904 94.779; 101.094; 91.342 | 2521.6 | Consuelo Yuste Vivas; Fernando S. Delgado; Catalina Ruiz-Pérez; Miguel Julve Preparation and crystal structure of the oxalato-bridged CrIII‒AgI two-dimensional compound {Ag3(H2O)[Cr(dpa)(ox)2]3}n·2nH2O (dpa = 2,2'-dipyridylamine) CrystEngComm, 2004, 6, 11-18 |
7204790 | CIF | C32 H16 Bi F15 N2 O S3 | P 1 21/n 1 | 9.4389; 18.206; 19.514 90; 94.385; 90 | 3343.6 | Charmant, Jonathan P. H.; Jahan, A. H. M. Monowar; Norman, Nicholas C.; Orpen, A. Guy; Podesta, Thomas J. Coordination polymers formed by Bi(SC6F5)3 with multidentate polypyridyl ligands CrystEngComm, 2004, 6, 29 |
7204791 | CIF | C33 H19 Bi F15 N3 O S3 | P 1 21/n 1 | 8.968; 16.616; 24.746 90; 97.14; 90 | 3658.9 | Charmant, Jonathan P. H.; Jahan, A. H. M. Monowar; Norman, Nicholas C.; Orpen, A. Guy; Podesta, Thomas J. Coordination polymers formed by Bi(SC6F5)3 with multidentate polypyridyl ligands CrystEngComm, 2004, 6, 29 |
7204792 | CIF | C38 H26 Bi F15 N2 O2 S3 | P -1 | 9.0368; 13.0086; 18.53 76.225; 82.026; 72.273 | 2010 | Charmant, Jonathan P. H.; Jahan, A. H. M. Monowar; Norman, Nicholas C.; Orpen, A. Guy; Podesta, Thomas J. Coordination polymers formed by Bi(SC6F5)3 with multidentate polypyridyl ligands CrystEngComm, 2004, 6, 29 |
7204793 | CIF | C36 H12 Bi F15 N6 S3 | P -1 | 7.5887; 14.181; 17.931 73.275; 78.66; 75.19 | 1770.8 | Charmant, Jonathan P. H.; Jahan, A. H. M. Monowar; Norman, Nicholas C.; Orpen, A. Guy; Podesta, Thomas J. Coordination polymers formed by Bi(SC6F5)3 with multidentate polypyridyl ligands CrystEngComm, 2004, 6, 29 |
7204794 | CIF | C36 H12 Bi F15 N6 S3 | P -1 | 9.034; 11.372; 17.894 75.17; 84.39; 86.23 | 1767 | Charmant, Jonathan P. H.; Jahan, A. H. M. Monowar; Norman, Nicholas C.; Orpen, A. Guy; Podesta, Thomas J. Coordination polymers formed by Bi(SC6F5)3 with multidentate polypyridyl ligands CrystEngComm, 2004, 6, 29 |
7204795 | CIF | C22 H19 N5 O8 | P -1 | 7.0051; 8.6187; 18.5866 101.186; 97.114; 101.401 | 1063.66 | Christer B. Aakeröy; John Desper; Brian A. Helfrich Heteromeric intermolecular interactions as synthetic tools for the formation of binary co-crystals CrystEngComm, 2004, 6, 19-24 |
7204796 | CIF | C13 H11 N3 O5 | P -1 | 5.9827; 9.1713; 12.1893 84.149; 77.407; 74.927 | 629.54 | Christer B. Aakeröy; John Desper; Brian A. Helfrich Heteromeric intermolecular interactions as synthetic tools for the formation of binary co-crystals CrystEngComm, 2004, 6, 19-24 |
7204797 | CIF | C13 H11 F N2 O3 | C 1 2/c 1 | 22.725; 5.231; 20.785 90; 95.402; 90 | 2460 | Christer B. Aakeröy; John Desper; Brian A. Helfrich Heteromeric intermolecular interactions as synthetic tools for the formation of binary co-crystals CrystEngComm, 2004, 6, 19-24 |
7204798 | CIF | C16 H16 N4 O7 | P -1 | 8.0266; 8.5974; 12.514 84.563; 89.934; 75.345 | 831.5 | Christer B. Aakeröy; John Desper; Brian A. Helfrich Heteromeric intermolecular interactions as synthetic tools for the formation of binary co-crystals CrystEngComm, 2004, 6, 19-24 |
7204799 | CIF | C16 H16 N2 O6 | P -1 | 7.1538; 7.9978; 14.315 91.111; 91.483; 111.582 | 761 | Christer B. Aakeröy; John Desper; Brian A. Helfrich Heteromeric intermolecular interactions as synthetic tools for the formation of binary co-crystals CrystEngComm, 2004, 6, 19-24 |
7204800 | CIF | C12 H11 N5 O4 | P -1 | 7.6155; 7.698; 21.587 95.59; 94.719; 90.268 | 1255.1 | Christer B. Aakeröy; John Desper; Brian A. Helfrich Heteromeric intermolecular interactions as synthetic tools for the formation of binary co-crystals CrystEngComm, 2004, 6, 19-24 |
7204809 | CIF | C38 H29 N O2 | P 1 21/n 1 | 10.375; 12.404; 22.1 90; 90.46; 90 | 2844 | Bourne, Susan A.; Corin, Kirsten C.; Nassimbeni, Luigi R.; Weber, Edwin pH control of guest selectivity by inclusion CrystEngComm, 2004, 6, 54 |
7204810 | CIF | C53 H49 N3 O2 | I -4 | 22.524; 22.524; 16.721 90; 90; 90 | 8483 | Bourne, Susan A.; Corin, Kirsten C.; Nassimbeni, Luigi R.; Weber, Edwin pH control of guest selectivity by inclusion CrystEngComm, 2004, 6, 54 |
7204815 | CIF | C38.5 H33.11 O4.06 | R -3 :H | 35.283; 35.283; 12.499 90; 90; 120 | 13475 | Ingeborg Csöregh; Shinya Hirano; Shinji Toyota; Petra Bombicz; Fumio Toda Versatility in stabilization of crystalline inclusion complexes of a bulky diol host by various closely related acidic and ester guests CrystEngComm, 2004, 6, 60-69 |
7204816 | CIF | C39 H33.39 O3.72 | R -3 :H | 35.329; 35.329; 12.437 90; 90; 120 | 13443 | Ingeborg Csöregh; Shinya Hirano; Shinji Toyota; Petra Bombicz; Fumio Toda Versatility in stabilization of crystalline inclusion complexes of a bulky diol host by various closely related acidic and ester guests CrystEngComm, 2004, 6, 60-69 |
7204817 | CIF | C39.33 H34 O3.56 | R -3 :H | 35.346; 35.346; 12.568 90; 90; 120 | 13598 | Ingeborg Csöregh; Shinya Hirano; Shinji Toyota; Petra Bombicz; Fumio Toda Versatility in stabilization of crystalline inclusion complexes of a bulky diol host by various closely related acidic and ester guests CrystEngComm, 2004, 6, 60-69 |
7204818 | CIF | C39.22 H34.5 O3.61 | R -3 :H | 35.248; 35.248; 12.507 90; 90; 120 | 13457.1 | Ingeborg Csöregh; Shinya Hirano; Shinji Toyota; Petra Bombicz; Fumio Toda Versatility in stabilization of crystalline inclusion complexes of a bulky diol host by various closely related acidic and ester guests CrystEngComm, 2004, 6, 60-69 |
7204819 | CIF | C39.39 H33.78 O3.22 | R -3 :H | 35.267; 35.267; 12.53 90; 90; 120 | 13496.4 | Ingeborg Csöregh; Shinya Hirano; Shinji Toyota; Petra Bombicz; Fumio Toda Versatility in stabilization of crystalline inclusion complexes of a bulky diol host by various closely related acidic and ester guests CrystEngComm, 2004, 6, 60-69 |
7204820 | CIF | C22 H10 F8 | P 1 21/n 1 | 7.3564; 6.2253; 18.6804 90; 97.946; 90 | 847.27 | Collings, Jonathan C.; Smith, Philip S.; Yufit, Dmitri S.; Batsanov, Andrei S.; Howard, Judith A. K.; Marder, Todd B. Arene?perfluoroarene interactions in crystal engineering. Part 10. Crystal structures of 1?1 complexes of octafluoronaphthalene with biphenyl and biphenyleneFor Part 9 see ref. 1. CrystEngComm, 2004, 6, 25 |
7204821 | CIF | C22 H8 F8 | P -1 | 6.446; 7.142; 9.751 74.46; 71.53; 85.97 | 410.17 | Collings, Jonathan C.; Smith, Philip S.; Yufit, Dmitri S.; Batsanov, Andrei S.; Howard, Judith A. K.; Marder, Todd B. Arene?perfluoroarene interactions in crystal engineering. Part 10. Crystal structures of 1?1 complexes of octafluoronaphthalene with biphenyl and biphenyleneFor Part 9 see ref. 1. CrystEngComm, 2004, 6, 25 |
7204822 | CIF | C52 H54 Cu F12 N4 O P2 S4 | P 1 2/c 1 | 15.37; 8.7969; 20.914 90; 99.398; 90 | 2789.8 | Holmes, Kathryn E.; Kelly, Paul F.; Elsegood, Mark R. J. Concomitant polymorphism of [Cu(Ph2SNH)4][PF6]2 CrystEngComm, 2004, 6, 56 |
7204823 | CIF | C48 H44 Cu F12 N4 P2 S4 | P -1 | 8.8849; 10.8557; 13.312 91.398; 103.569; 92.897 | 1245.66 | Holmes, Kathryn E.; Kelly, Paul F.; Elsegood, Mark R. J. Concomitant polymorphism of [Cu(Ph2SNH)4][PF6]2 CrystEngComm, 2004, 6, 56 |
7204824 | CIF | C48 H44 Cu F12 N4 P2 S4 | P 1 21/n 1 | 14.3809; 19.8714; 18.1471 90; 103.481; 90 | 5043 | Holmes, Kathryn E.; Kelly, Paul F.; Elsegood, Mark R. J. Concomitant polymorphism of [Cu(Ph2SNH)4][PF6]2 CrystEngComm, 2004, 6, 56 |
7204825 | CIF | C18 H18 Cl2 N2 S2 | P b c a | 9.1712; 18.3898; 21.6441 90; 90; 90 | 3650.4 | Holmes, Kathryn E.; Gilby, Liam M.; Stonehouse, Julia M.; Kelly, Paul F.; Elsegood, Mark R. J. The preparation and crystal structures of derivatised sulfimidium salts CrystEngComm, 2004, 6, 34 |
7204826 | CIF | C12 H12 Cl N O S | P b c a | 9.0907; 9.8349; 27.2937 90; 90; 90 | 2440.22 | Holmes, Kathryn E.; Gilby, Liam M.; Stonehouse, Julia M.; Kelly, Paul F.; Elsegood, Mark R. J. The preparation and crystal structures of derivatised sulfimidium salts CrystEngComm, 2004, 6, 34 |
7204827 | CIF | C12 H12 Cl N O S | P 1 21/c 1 | 13.5552; 5.6845; 15.508 90; 91.335; 90 | 1194.6 | Holmes, Kathryn E.; Gilby, Liam M.; Stonehouse, Julia M.; Kelly, Paul F.; Elsegood, Mark R. J. The preparation and crystal structures of derivatised sulfimidium salts CrystEngComm, 2004, 6, 34 |
7204831 | CIF | C32 H24 N2 O8.98 Rh2 | C 1 2/c 1 | 17.485; 9.5925; 19.611 90; 99.219; 90 | 3246.8 | Takamizawa, Satoshi; Nakata, Ei-ichi; Saito, Teruo Structural determination of a 1-D metal?organic framework with adsorbed oxygen molecules at 10 K: possibility of surface motion transfer of confined guest CrystEngComm, 2004, 6, 39 |
7204832 | CIF | C36 H42 Cu N4 O13 P2 | P -1 | 10.891; 13.357; 14.642 84.15; 74.79; 77.36 | 2003.3 | Clarke, Rachael; Latham, Kay; Rix, Colin; Hobday, Malcolm; White, Jonathan Supramolecular bidentate amine derivatives of copper(ii) organophosphonates CrystEngComm, 2004, 6, 42 |
7204833 | CIF | C38 H34 Cu N4 O11.5 P2 | C 1 2/c 1 | 33.209; 10.097; 27.247 90; 119.38; 90 | 7961 | Clarke, Rachael; Latham, Kay; Rix, Colin; Hobday, Malcolm; White, Jonathan Supramolecular bidentate amine derivatives of copper(ii) organophosphonates CrystEngComm, 2004, 6, 42 |
7204844 | CIF | C14 H20 Cl4 Co N2 | P 1 21 1 | 7.381; 14.5798; 8.6905 90; 103.661; 90 | 908.76 | Marina Felloni; Peter Hubberstey; Claire Wilson; Martin Schröder Conserved hydrogen-bonded supramolecular synthons in pyridinium tetrachlorometallates CrystEngComm, 2004, 6, 87-95 |
7204845 | CIF | C10 H12 Cl4 Co N2 | P -1 | 7.5802; 7.9849; 12.4508 89.026; 83.51; 79.833 | 737.02 | Marina Felloni; Peter Hubberstey; Claire Wilson; Martin Schröder Conserved hydrogen-bonded supramolecular synthons in pyridinium tetrachlorometallates CrystEngComm, 2004, 6, 87-95 |
7204846 | CIF | C165 H180 N10 Ni2 O18 | P 1 | 14.62; 16.079; 16.193 78.201; 80.798; 76.345 | 3595.8 | Ohmori, Osamu; Kawano, Masaki; Fujita, Makoto A 24 � 24 � square ladder CrystEngComm, 2004, 6, 51 |
7204847 | CIF | C70 H80 N5 Ni O10 | P -1 | 14.332; 15.179; 16.165 79.406; 69.285; 74.921 | 3159.6 | Ohmori, Osamu; Kawano, Masaki; Fujita, Makoto A 24 � 24 � square ladder CrystEngComm, 2004, 6, 51 |
7204848 | CIF | C13 H26 B2 Cu F8 N10 O5 | P -1 | 10.7999; 11.3654; 11.8496 116.093; 92.31; 106.55 | 1228.74 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Wilson, Claire Hydrogen-bonded binding of DNA pyrimidine bases to copper(ii) cations co-ordinated by polymethylene linked bis(amidino-O-alkylurea) ligands to form supramolecular architectures CrystEngComm, 2004, 6, 70 |
7204849 | CIF | C16 H28 B2 Cu F8 N14 O4 | P -1 | 7.182; 12.055; 16.888 95.19; 99.573; 101.294 | 1402.4 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Wilson, Claire Hydrogen-bonded binding of DNA pyrimidine bases to copper(ii) cations co-ordinated by polymethylene linked bis(amidino-O-alkylurea) ligands to form supramolecular architectures CrystEngComm, 2004, 6, 70 |
7204850 | CIF | C14 H8 Cl2 | P -1 | 3.9004; 8.7632; 16.508 105.33; 90.09; 100.97 | 533.4 | Li, Qi; Hu, Chunhua; Haerter, Roland; Englert, Ulli Isosteric molecules in non-isomorphous structures: A new route to new structures. The example of 9,10-dihaloanthracene CrystEngComm, 2004, 6, 83 |
7204851 | CIF | C14 H8 Br0.5 Cl1.5 | P -1 | 3.8629; 8.743; 16.515 105.203; 90.179; 100.495 | 528.5 | Li, Qi; Hu, Chunhua; Haerter, Roland; Englert, Ulli Isosteric molecules in non-isomorphous structures: A new route to new structures. The example of 9,10-dihaloanthracene CrystEngComm, 2004, 6, 83 |
7204852 | CIF | C27 H15 Cl3 O3 | P c a 21 | 10.4381; 9.0183; 48.0553 90; 90; 90 | 4523.6 | Kumar, V. S. Senthil; Pigge, F. Christopher; Rath, Nigam P. Polymorphism in 1,3,5-triaroylbenzenes: structural characterization of concomitant polymorphs obtained from 1,3,5-tris(4-chlorobenzoyl)benzene CrystEngComm, 2004, 6, 102 |
7204853 | CIF | C27 H15 Cl3 O3 | P -1 | 8.6385; 11.1276; 12.4701 95.955; 97.735; 106.98 | 1122.99 | Kumar, V. S. Senthil; Pigge, F. Christopher; Rath, Nigam P. Polymorphism in 1,3,5-triaroylbenzenes: structural characterization of concomitant polymorphs obtained from 1,3,5-tris(4-chlorobenzoyl)benzene CrystEngComm, 2004, 6, 102 |
7204855 | CIF | C18 H16 Ag N3 O4 | P -1 | 7.5132; 8.3575; 13.9439 106.836; 95.865; 94.138 | 828.87 | Sergey Z. Vatsadze; Marina A. Kovalkina; Natal'ya V. Sviridenkova; Nikolai V. Zyk; Andrei V. Churakov; Lyudmila G. Kuz'mina; Judith A. K. Howard Novel dienone-based ligands for the synthesis of coordination polymers CrystEngComm, 2004, 6, 112-115 |
7204856 | CIF | C18 H16 N2 O | P -1 | 9.0541; 9.3447; 9.7248 81.711; 70.102; 64.45 | 698.01 | Sergey Z. Vatsadze; Marina A. Kovalkina; Natal'ya V. Sviridenkova; Nikolai V. Zyk; Andrei V. Churakov; Lyudmila G. Kuz'mina; Judith A. K. Howard Novel dienone-based ligands for the synthesis of coordination polymers CrystEngComm, 2004, 6, 112-115 |
7204860 | CIF | C14 H22 Cu N4 O8 S | P -1 | 7.96; 10.122; 12.782 67.234; 84.407; 80.782 | 936.7 | Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.; Spadacini, Laura Supramolecular isomers in the same crystal: a new case involving two different types of layers polycatenated in the 3D architecture of [Cu(bix)2(SO4)]�7.5H2O [bix = 1,4-bis(imidazol-1-ylmethyl)benzene] CrystEngComm, 2004, 6, 96 |
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