Crystallography Open Database
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Searching journal of publication like 'CrystEngComm' volume of publication is 5
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
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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 |
7204894 | CIF | C8 H12 Hg2 O4 S8 | P b c a | 10.605; 8.003; 23.478 90; 90; 90 | 1992.6 | Tiekink, Edward R. T. Molecular architecture and supramolecular association in the zinc-triad 1,1-dithiolates. Steric control as a design element in crystal engineering? CrystEngComm, 2003, 5, 101 |
7204895 | CIF | C18 H36 Hg N2 S4 | C 1 2/c 1 | 26.27; 13.654; 13.863 90; 96.64; 90 | 4939 | Tiekink, Edward R. T. Molecular architecture and supramolecular association in the zinc-triad 1,1-dithiolates. Steric control as a design element in crystal engineering? CrystEngComm, 2003, 5, 101 |
7204896 | CIF | C10 H15 Hg P S2 | P 1 21/c 1 | 6.238; 20.162; 11.281 90; 104.63; 90 | 1372.8 | 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 |
7204897 | CIF | C6 H12 Hg N2 S4 | C 1 2/c 1 | 17.308; 7.558; 9.978 90; 113.24; 90 | 1199.4 | Tiekink, Edward R. T. Molecular architecture and supramolecular association in the zinc-triad 1,1-dithiolates. Steric control as a design element in crystal engineering? CrystEngComm, 2003, 5, 101 |
7204899 | CIF | C20 H40 N4 S8 Zn2 | P 1 21/n 1 | 9.814; 10.667; 15.655 90; 104.06; 90 | 1589.8 | Tiekink, Edward R. T. Molecular architecture and supramolecular association in the zinc-triad 1,1-dithiolates. Steric control as a design element in crystal engineering? CrystEngComm, 2003, 5, 101 |
7204900 | CIF | C10 H20 Cd N2 S4 | P 1 21/c 1 | 9.8208; 10.7609; 15.9952 90; 103.581; 90 | 1643.12 | Tiekink, Edward R. T. Molecular architecture and supramolecular association in the zinc-triad 1,1-dithiolates. Steric control as a design element in crystal engineering? CrystEngComm, 2003, 5, 101 |
7205040 | CIF | C19 H12 N4 O6 | P 1 21/n 1 | 11.741; 12.828; 12.047 90; 108.46; 90 | 1721.1 | Thallapally, Praveen K.; Katz, A. K.; Carrell, H. L.; Desiraju, Gautam R. C‒H⋯O hydrogen bonds in molecular complexes of 1,3,5-trinitrobenzene with some N-heterocycles CrystEngComm, 2003, 5, 87 |
7205041 | CIF | C18 H11 N5 O6 | P 1 21/n 1 | 10.962; 13.48; 12.092 90; 108.89; 90 | 1690.6 | Thallapally, Praveen K.; Katz, A. K.; Carrell, H. L.; Desiraju, Gautam R. C‒H⋯O hydrogen bonds in molecular complexes of 1,3,5-trinitrobenzene with some N-heterocycles CrystEngComm, 2003, 5, 87 |
7205042 | CIF | C24 H15 N6 O6 | P -1 | 7.0781; 9.7139; 15.787 86.83; 88.33; 83.08 | 1075.6 | Thallapally, Praveen K.; Katz, A. K.; Carrell, H. L.; Desiraju, Gautam R. C–H⋯O hydrogen bonds in molecular complexes of 1,3,5-trinitrobenzene with some N-heterocycles CrystEngComm, 2003, 5, 87 |
7205043 | CIF | C39 H30 Cl2 Cr N6 O2 S14 | P -1 | 13.977; 18.93; 10.148 105.71; 106.23; 82.19 | 2476 | Sayaduzzaman, Mohammad; Katsuhara, Mao; Nii, Hirofumi; Kawamoto, Tadashi; Mori, Takehiko Structural and magnetic properties of (C2TEO-TTP)[Cr(isoq)2(NCS)4]�CH2Cl2 CrystEngComm, 2003, 5, 300 |
7216268 | CIF | C74 H51.5 Cu N9.5 O12 | P 1 21/n 1 | 10.484; 19.531; 31.33 90; 93.382; 90 | 6404.1 | Vinodu, Mikki; Goldberg, Israel Porphyrin networks. Synthesis and supramolecular self-assembly of 5,10,15-tri(4-hydroxyphenyl)-20-(2-quinolyl) metalloporphyrins CrystEngComm, 2003, 5, 490 |
7216269 | CIF | C65 H46 N8 O10 Zn | P 1 21/n 1 | 16.188; 19.606; 18.203 90; 109.438; 90 | 5448 | Vinodu, Mikki; Goldberg, Israel Porphyrin networks. Synthesis and supramolecular self-assembly of 5,10,15-tri(4-hydroxyphenyl)-20-(2-quinolyl) metalloporphyrins CrystEngComm, 2003, 5, 490 |
7216270 | CIF | C18 H18 O3 | C 1 c 1 | 14.391; 20.228; 9.782 90; 91.96; 90 | 2845.9 | Aitipamula, Srinivasulu; Desiraju, Gautam R.; Jaskólski, Mariusz; Nangia, Ashwini; Thaimattam, Ram Multiple molecules in the crystallographic asymmetric unit. Self host‒guest and doubly interpenetrated hydrogen bond networks in a pair of keto-bisphenols CrystEngComm, 2003, 5, 447 |
7216271 | CIF | C20 H22 O3 | P 1 21/n 1 | 10.004; 15.783; 20.253 90; 94.79; 90 | 3186.6 | Aitipamula, Srinivasulu; Desiraju, Gautam R.; Jaskólski, Mariusz; Nangia, Ashwini; Thaimattam, Ram Multiple molecules in the crystallographic asymmetric unit. Self host‒guest and doubly interpenetrated hydrogen bond networks in a pair of keto-bisphenols CrystEngComm, 2003, 5, 447 |
7216272 | CIF | C32.77 H24 N2 O9.54 Rh2 | P -1 | 9.572; 10.424; 10.977 71.27; 66.062; 63.155 | 880.3 | Takamizawa, Satoshi; Nakata, Ei-ichi; Saito, Teruo; Kojima, Kenichi Structural determination of physisorbed sites for CO2 and Ar gases inside an organometallic framework CrystEngComm, 2003, 5, 411 |
7216273 | CIF | C32 H24 Ar1.12 N2 O8 Rh2 | P -1 | 9.588; 10.322; 10.861 72.139; 64.783; 62.722 | 856 | Takamizawa, Satoshi; Nakata, Ei-ichi; Saito, Teruo; Kojima, Kenichi Structural determination of physisorbed sites for CO2 and Ar gases inside an organometallic framework CrystEngComm, 2003, 5, 411 |
7216274 | CIF | C26 H29 N O | P -1 | 11.3947; 15.7982; 18.4861 91.028; 99.107; 93.377 | 3278.88 | Caira, Mino R.; Nassimbeni, Luigi R.; Su, Hong; Weber, Edwin Temperature-dependent phase transition in a phenylfluorenol inclusion compound CrystEngComm, 2003, 5, 351 |
7216275 | CIF | C26 H29 N O | P -1 | 8.7451; 11.472; 12.336 100.72; 96.13; 111.23 | 1112.8 | Caira, Mino R.; Nassimbeni, Luigi R.; Su, Hong; Weber, Edwin Temperature-dependent phase transition in a phenylfluorenol inclusion compound CrystEngComm, 2003, 5, 351 |
7216276 | CIF | C15 H16 N2 O4 | P b c a | 19.763; 13.835; 10.175 90; 90; 90 | 2782.1 | Trivedi, Darshak R.; Ballabh, Amar; Dastidar, Parthasarathi Supramolecular assemblies in salts and co-crystals of imidazoles with dicarboxylic acids CrystEngComm, 2003, 5, 358 |
7216277 | CIF | C6 H7 N2 O5.57 | P -1 | 7.231; 8.296; 9.235 115.97; 102.84; 91.74 | 480.4 | Trivedi, Darshak R.; Ballabh, Amar; Dastidar, Parthasarathi Supramolecular assemblies in salts and co-crystals of imidazoles with dicarboxylic acids CrystEngComm, 2003, 5, 358 |
7216278 | CIF | C11 H9.5 N2 O4 | P 1 21/c 1 | 9.639; 5.083; 23.066 90; 106.817; 90 | 1081.8 | Trivedi, Darshak R.; Ballabh, Amar; Dastidar, Parthasarathi Supramolecular assemblies in salts and co-crystals of imidazoles with dicarboxylic acids CrystEngComm, 2003, 5, 358 |
7216279 | CIF | C15 H10 N2 O4 | P 1 21/c 1 | 10.157; 5.13; 26.067 90; 90.98; 90 | 1358 | Trivedi, Darshak R.; Ballabh, Amar; Dastidar, Parthasarathi Supramolecular assemblies in salts and co-crystals of imidazoles with dicarboxylic acids CrystEngComm, 2003, 5, 358 |
7216280 | CIF | C10 H6 O3 | P 1 21/c 1 | 3.824; 9.108; 22.252 90; 91.263; 90 | 774.8 | Moorthy, J. Narasimha; Venkatakrishnan, P.; Singh, Ashutosh S. Molecular self-assembly: 4-formylcoumarins as versatile skeletons for complementary multipoint association via weak (C?H?O, C?H?F and C?X?O?C) interactions CrystEngComm, 2003, 5, 507 |
7216281 | CIF | C10 H5 Cl O3 | P 1 21/n 1 | 7.098; 8.58; 14.328 90; 97.913; 90 | 864.3 | Moorthy, J. Narasimha; Venkatakrishnan, P.; Singh, Ashutosh S. Molecular self-assembly: 4-formylcoumarins as versatile skeletons for complementary multipoint association via weak (C?H?O, C?H?F and C?X?O?C) interactions CrystEngComm, 2003, 5, 507 |
7216282 | CIF | C10 H5 Cl O3 | P 1 21/n 1 | 7.984; 5.939; 18.452 90; 101.333; 90 | 857.9 | Moorthy, J. Narasimha; Venkatakrishnan, P.; Singh, Ashutosh S. Molecular self-assembly: 4-formylcoumarins as versatile skeletons for complementary multipoint association via weak (C?H?O, C?H?F and C?X?O?C) interactions CrystEngComm, 2003, 5, 507 |
7216283 | CIF | C10 H5 Br O3 | P 1 21/c 1 | 8.122; 10.216; 10.709 90; 92.753; 90 | 887.5 | Moorthy, J. Narasimha; Venkatakrishnan, P.; Singh, Ashutosh S. Molecular self-assembly: 4-formylcoumarins as versatile skeletons for complementary multipoint association via weak (C?H?O, C?H?F and C?X?O?C) interactions CrystEngComm, 2003, 5, 507 |
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