Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
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|---|---|---|---|---|---|---|
| 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 catalysis CrystEngComm, 2003, 5, 180-189 |
| 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 catalysis CrystEngComm, 2003, 5, 180-189 |
| 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 catalysis CrystEngComm, 2003, 5, 180-189 |
| 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 |
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