Crystallography Open Database

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1514984 CIFC35 H41 B O7P -18.0671; 12.5459; 15.4229
83.045; 83.617; 81.899
1526.94Gong, Wei; Singidi, Ramakrishna Reddy; Gallucci, Judith C.; RajanBabu, T. V.
On the stereochemistry of acetylide additions to highly functionalized biphenylcarbaldehydes and multi-component cyclization of 1,n-diynes. Syntheses of dibenzocyclooctadiene lignans
Chemical Science, 2012, 3, 1221
1514985 CIFC28 H35 N O7 SiP 1 21 111.4194; 10.9563; 12.2162
90; 104.877; 90
1477.19Gong, Wei; Singidi, Ramakrishna Reddy; Gallucci, Judith C.; RajanBabu, T. V.
On the stereochemistry of acetylide additions to highly functionalized biphenylcarbaldehydes and multi-component cyclization of 1,n-diynes. Syntheses of dibenzocyclooctadiene lignans
Chemical Science, 2012, 3, 1221
1514986 CIFC28 H35 N O7 SiP 21 21 2110.6948; 14.0253; 18.4358
90; 90; 90
2765.33Gong, Wei; Singidi, Ramakrishna Reddy; Gallucci, Judith C.; RajanBabu, T. V.
On the stereochemistry of acetylide additions to highly functionalized biphenylcarbaldehydes and multi-component cyclization of 1,n-diynes. Syntheses of dibenzocyclooctadiene lignans
Chemical Science, 2012, 3, 1221
1514987 CIFC28 H36 O6 Si2P -110.3358; 10.7754; 13.7612
103.096; 100.398; 91.195
1465.19Gong, Wei; Singidi, Ramakrishna Reddy; Gallucci, Judith C.; RajanBabu, T. V.
On the stereochemistry of acetylide additions to highly functionalized biphenylcarbaldehydes and multi-component cyclization of 1,n-diynes. Syntheses of dibenzocyclooctadiene lignans
Chemical Science, 2012, 3, 1221
1514988 CIFC29 H37 N O8 SiP 21 21 2110.1179; 13.7992; 21.5342
90; 90; 90
3006.58Gong, Wei; Singidi, Ramakrishna Reddy; Gallucci, Judith C.; RajanBabu, T. V.
On the stereochemistry of acetylide additions to highly functionalized biphenylcarbaldehydes and multi-component cyclization of 1,n-diynes. Syntheses of dibenzocyclooctadiene lignans
Chemical Science, 2012, 3, 1221
1514989 CIFC38 H47 B O8 SnP -110.8449; 13.7385; 14.5994
78.148; 75.225; 70.556
1965.93Gong, Wei; Singidi, Ramakrishna Reddy; Gallucci, Judith C.; RajanBabu, T. V.
On the stereochemistry of acetylide additions to highly functionalized biphenylcarbaldehydes and multi-component cyclization of 1,n-diynes. Syntheses of dibenzocyclooctadiene lignans
Chemical Science, 2012, 3, 1221
1514990 CIFC35 H39 B O8P 1 21/c 110.2127; 10.942; 28.6657
90; 98.392; 90
3169.02Gong, Wei; Singidi, Ramakrishna Reddy; Gallucci, Judith C.; RajanBabu, T. V.
On the stereochemistry of acetylide additions to highly functionalized biphenylcarbaldehydes and multi-component cyclization of 1,n-diynes. Syntheses of dibenzocyclooctadiene lignans
Chemical Science, 2012, 3, 1221
1514991 CIFC37 H57 Ni P3 SiP b c a16.1008; 16.9634; 25.931
90; 90; 90
7082.4Tsay, Charlene; Peters, Jonas C.
Thermally stable N2 and H2 adducts of cationic nickel(ii)
Chemical Science, 2012, 3, 1313
1514992 CIFC77.75 H75.75 B F24 N2 Ni P3 SiC 1 2/c 147.534; 13.9003; 30.423
90; 128.63; 90
15703Tsay, Charlene; Peters, Jonas C.
Thermally stable N2 and H2 adducts of cationic nickel(ii)
Chemical Science, 2012, 3, 1313
1514993 CIFC70 H69 B F24 N Ni P3 SiP 1 21/c 112.8286; 14.9103; 38.095
90; 96.779; 90
7235.8Tsay, Charlene; Peters, Jonas C.
Thermally stable N2 and H2 adducts of cationic nickel(ii)
Chemical Science, 2012, 3, 1313
1514994 CIFC69 H66 B Cl F24 Ni O P3 SiP b c a26.3375; 19.5435; 27.2078
90; 90; 90
14004.6Tsay, Charlene; Peters, Jonas C.
Thermally stable N2 and H2 adducts of cationic nickel(ii)
Chemical Science, 2012, 3, 1313
1514995 CIFC36 H55 Cl Ni P3 SiP -110.9905; 11.1304; 16.8144
78.237; 79.052; 61.648
1761.8Tsay, Charlene; Peters, Jonas C.
Thermally stable N2 and H2 adducts of cationic nickel(ii)
Chemical Science, 2012, 3, 1313
1514996 CIFC86 H54 B F24 N2 Ni P3 SiP -113.2952; 15.4595; 20.2687
74.996; 84.981; 83.775
3992.6Tsay, Charlene; Peters, Jonas C.
Thermally stable N2 and H2 adducts of cationic nickel(ii)
Chemical Science, 2012, 3, 1313
1514997 CIFC87 H54 B F24 Ni O P3 SiP -113.2892; 15.457; 20.2883
74.851; 85.107; 83.842
3992.3Tsay, Charlene; Peters, Jonas C.
Thermally stable N2 and H2 adducts of cationic nickel(ii)
Chemical Science, 2012, 3, 1313
1514998 CIFC37 H32 Cl2 N2C 1 2/c 128.982; 11.074; 9.7067
90; 101.66; 90
3051Meisner, Jeffrey S.; Sedbrook, Danielle F.; Krikorian, Markrete; Chen, Jun; Sattler, Aaron; Carnes, Matthew E.; Murray, Christopher B.; Steigerwald, Michael; Nuckolls, Colin
Functionalizing molecular wires: a tunable class of α,ω-diphenyl-μ,ν-dicyano-oligoenes
Chemical Science, 2012, 3, 1007
1514999 CIFC41 H35 Cl2 N2C 1 2/c 132.92; 11.005; 9.624
90; 106.563; 90
3342Meisner, Jeffrey S.; Sedbrook, Danielle F.; Krikorian, Markrete; Chen, Jun; Sattler, Aaron; Carnes, Matthew E.; Murray, Christopher B.; Steigerwald, Michael; Nuckolls, Colin
Functionalizing molecular wires: a tunable class of α,ω-diphenyl-μ,ν-dicyano-oligoenes
Chemical Science, 2012, 3, 1007
1515000 CIFC20 H14 N2P 1 21/n 110.7874; 6.1038; 11.5494
90; 104.177; 90
737.3Meisner, Jeffrey S.; Sedbrook, Danielle F.; Krikorian, Markrete; Chen, Jun; Sattler, Aaron; Carnes, Matthew E.; Murray, Christopher B.; Steigerwald, Michael; Nuckolls, Colin
Functionalizing molecular wires: a tunable class of α,ω-diphenyl-μ,ν-dicyano-oligoenes
Chemical Science, 2012, 3, 1007
1515001 CIFC32 H32 N4 O6P -16.2483; 7.152; 16.741
101.417; 91.557; 92.041
732.4Meisner, Jeffrey S.; Sedbrook, Danielle F.; Krikorian, Markrete; Chen, Jun; Sattler, Aaron; Carnes, Matthew E.; Murray, Christopher B.; Steigerwald, Michael; Nuckolls, Colin
Functionalizing molecular wires: a tunable class of α,ω-diphenyl-μ,ν-dicyano-oligoenes
Chemical Science, 2012, 3, 1007
1515002 CIFC24 H18 N2P 1 21/n 112.5981; 6.0734; 13.4724
90; 117.737; 90
912.37Meisner, Jeffrey S.; Sedbrook, Danielle F.; Krikorian, Markrete; Chen, Jun; Sattler, Aaron; Carnes, Matthew E.; Murray, Christopher B.; Steigerwald, Michael; Nuckolls, Colin
Functionalizing molecular wires: a tunable class of α,ω-diphenyl-μ,ν-dicyano-oligoenes
Chemical Science, 2012, 3, 1007
1515003 CIFC29 H23 Cl2 N2C 1 2/c 122.398; 11.1946; 9.7652
90; 95.645; 90
2436.6Meisner, Jeffrey S.; Sedbrook, Danielle F.; Krikorian, Markrete; Chen, Jun; Sattler, Aaron; Carnes, Matthew E.; Murray, Christopher B.; Steigerwald, Michael; Nuckolls, Colin
Functionalizing molecular wires: a tunable class of α,ω-diphenyl-μ,ν-dicyano-oligoenes
Chemical Science, 2012, 3, 1007
1515004 CIFC33 H28 Cl2 N2C 1 2/c 125.388; 11.126; 9.788
90; 94.187; 90
2757Meisner, Jeffrey S.; Sedbrook, Danielle F.; Krikorian, Markrete; Chen, Jun; Sattler, Aaron; Carnes, Matthew E.; Murray, Christopher B.; Steigerwald, Michael; Nuckolls, Colin
Functionalizing molecular wires: a tunable class of α,ω-diphenyl-μ,ν-dicyano-oligoenes
Chemical Science, 2012, 3, 1007
1515005 CIFC44 H42 Cl3 N7 O7P 1 21/c 19.5229; 39.529; 11.6647
90; 98.282; 90
4345.2Engle, Jeffrey M.; Carroll, Calden N.; Johnson, Darren W.; Haley, Michael M.
Synthesis and optoelectronic properties of 2,6-bis(2-anilinoethynyl)pyridine scaffolds
Chemical Science, 2012, 3, 1105
1515006 CIFC72 H102 Nb2 O6 P4P 1 21/c 118.9443; 21.565; 17.9908
90; 99.909; 90
7240.2Velian, Alexandra; Cummins, Christopher C.
Synthesis of a diniobium tetraphosphorus complex by a 2(3−1) process
Chemical Science, 2012, 3, 1003
1515007 CIFC46 H78 Co3 I4 N4 O5P 1 21/c 111.79263; 21.62584; 22.16086
90; 102.592; 90
5515.64Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K.
Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism?
Chemical Science, 2012, 3, 1245
1515008 CIFC46 H78 Br4 Co3 N4 O5P 1 21/c 111.69346; 20.8757; 22.0206
90; 102.034; 90
5257.3Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K.
Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism?
Chemical Science, 2012, 3, 1245
1515009 CIFC75.5 H123 Cl20 Co4 K N8 O4P n m a23.2374; 30.6555; 14.1318
90; 90; 90
10066.8Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K.
Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism?
Chemical Science, 2012, 3, 1245
1515010 CIFC76 H124 Cl21 Co4 K N8 O4P 1 21/c 111.78965; 31.1301; 27.4398
90; 96.1289; 90
10013.2Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K.
Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism?
Chemical Science, 2012, 3, 1245
1515011 CIFC42 H74 Cl7 Co2 N5 O2P 1 21/n 114.4425; 21.581; 16.8129
90; 105.087; 90
5059.69Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K.
Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism?
Chemical Science, 2012, 3, 1245
1515012 CIFC50 H86 Cl3 Co2 N6 O3P -112.4636; 15.6121; 15.8197
69.978; 71.369; 85.244
2739.42Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K.
Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism?
Chemical Science, 2012, 3, 1245
1515013 CIFC42 H70 Cl3 Co2 N7 O2P 1 21/n 115.09; 20.2875; 15.702
90; 104.082; 90
4662.54Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K.
Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism?
Chemical Science, 2012, 3, 1245
1515014 CIFC46 H76 Cl2 Co2 N6 O4P -111.3806; 13.8405; 15.7508
96.278; 96.347; 91.87
2448.45Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K.
Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism?
Chemical Science, 2012, 3, 1245
1515015 CIFC45.5 H73 Cl11 Co2 N6 O2C 1 2/c 135.3728; 20.4934; 19.9836
90; 124.046; 90
12003.2Kember, Michael R.; Jutz, Fabian; Buchard, Antoine; White, Andrew J. P.; Williams, Charlotte K.
Di-cobalt(ii) catalysts for the copolymerisation of CO2 and cyclohexene oxide: support for a dinuclear mechanism?
Chemical Science, 2012, 3, 1245
1515016 CIFC24 H28 Cl8 I4 N8 O8P 42/n m c :218.1726; 18.1726; 7.0372
90; 90; 90
2323.99Raatikainen, Kari; Rissanen, Kari
Breathing molecular crystals: halogen- and hydrogen-bonded porous molecular crystals with solvent induced adaptation of the nanosized channels
Chemical Science, 2012, 3, 1235
1515017 CIFC23 H29 Cl3 I4 N8 O8C 1 2/c 126.3584; 7.034; 21.0654
90; 109.216; 90
3688.03Raatikainen, Kari; Rissanen, Kari
Breathing molecular crystals: halogen- and hydrogen-bonded porous molecular crystals with solvent induced adaptation of the nanosized channels
Chemical Science, 2012, 3, 1235
1515018 CIFC26 H36 Cl8 I4 N8 O8P 43 21 217.2587; 17.2587; 15.5855
90; 90; 90
4642.34Raatikainen, Kari; Rissanen, Kari
Breathing molecular crystals: halogen- and hydrogen-bonded porous molecular crystals with solvent induced adaptation of the nanosized channels
Chemical Science, 2012, 3, 1235
1515019 CIFC26 H40 I4 N12 O16I -4 c 216.8566; 16.8566; 14.5819
90; 90; 90
4143.37Raatikainen, Kari; Rissanen, Kari
Breathing molecular crystals: halogen- and hydrogen-bonded porous molecular crystals with solvent induced adaptation of the nanosized channels
Chemical Science, 2012, 3, 1235
1515020 CIFC29 H36 I4 N8 O8C 1 2/c 126.0769; 7.0625; 20.9842
90; 108.622; 90
3662.29Raatikainen, Kari; Rissanen, Kari
Breathing molecular crystals: halogen- and hydrogen-bonded porous molecular crystals with solvent induced adaptation of the nanosized channels
Chemical Science, 2012, 3, 1235
1515022 CIFC90 H77 N12 O7 U3P 1 21/n 116.7294; 16.6323; 29.5917
90; 90.954; 90
8232.7Chatelain, Lucile; Mougel, Victor; Pécaut, Jacques; Mazzanti, Marinella
Magnetic communication and reactivity of a stable homometallic cation‒cation trimer of pentavalent uranyl
Chemical Science, 2012, 3, 1075
1515023 CIFC29 H23 Cl3 N4 O2 UP -17.2599; 12.1368; 16.1046
99.775; 90.893; 95.133
1392.11Chatelain, Lucile; Mougel, Victor; Pécaut, Jacques; Mazzanti, Marinella
Magnetic communication and reactivity of a stable homometallic cation‒cation trimer of pentavalent uranyl
Chemical Science, 2012, 3, 1075
1515024 CIFC57.5 H44.25 N8.75 O5 U2C 1 2/c 127.1234; 27.366; 28.2322
90; 90.531; 90
20954.7Chatelain, Lucile; Mougel, Victor; Pécaut, Jacques; Mazzanti, Marinella
Magnetic communication and reactivity of a stable homometallic cation‒cation trimer of pentavalent uranyl
Chemical Science, 2012, 3, 1075
1515025 CIFC52 H66 Cl2 Hg N O SbP 1 21/n 111.172; 34.082; 12.621
90; 99.244; 90
4743Lin, Tzu-Pin; Nelson, Ryan C.; Wu, Tianpin; Miller, Jeffrey T.; Gabbaï, François P.
Lewis acid enhancement by juxtaposition with an onium ion: the case of a mercury stibonium complex
Chemical Science, 2012, 3, 1128
1515026 CIFC57 H60 F6 Hg N6 O P SbC 1 c 118.171; 28.753; 13.422
90; 130.397; 90
5341Lin, Tzu-Pin; Nelson, Ryan C.; Wu, Tianpin; Miller, Jeffrey T.; Gabbaï, François P.
Lewis acid enhancement by juxtaposition with an onium ion: the case of a mercury stibonium complex
Chemical Science, 2012, 3, 1128
1515027 CIFC68 H52 F2 Hg2 O Sb2P -112.689; 13.651; 16.06
97.184; 95.058; 102.804
2672Lin, Tzu-Pin; Nelson, Ryan C.; Wu, Tianpin; Miller, Jeffrey T.; Gabbaï, François P.
Lewis acid enhancement by juxtaposition with an onium ion: the case of a mercury stibonium complex
Chemical Science, 2012, 3, 1128
1515028 CIFC38 H34 F6 Hg O1.5 P SbP 1 21/c 113.2206; 21.054; 13.5998
90; 118.154; 90
3337.6Lin, Tzu-Pin; Nelson, Ryan C.; Wu, Tianpin; Miller, Jeffrey T.; Gabbaï, François P.
Lewis acid enhancement by juxtaposition with an onium ion: the case of a mercury stibonium complex
Chemical Science, 2012, 3, 1128
1515029 CIFC18 H29 I N4 O Pd S2P -111.0114; 14.456; 15.04
86.364; 88.837; 84.021
2376Liu, Jing; Deng, Yi; Lin, Caitao; Lei, Aiwen
“Push effect” of sulfur coordination: promoting the breaking of C(sp2)‒I bond by pincer thioimido-Pd(ii) complexes
Chemical Science, 2012, 3, 1211
1515030 CIFC28 H33 N5 Pd S3P -19.4934; 12.8359; 12.9362
85.96; 70.27; 84.36
1475.5Liu, Jing; Deng, Yi; Lin, Caitao; Lei, Aiwen
“Push effect” of sulfur coordination: promoting the breaking of C(sp2)‒I bond by pincer thioimido-Pd(ii) complexes
Chemical Science, 2012, 3, 1211
1515031 CIFC88 H178 Cu5 Ga30 N23 S54P -122.414; 23.022; 23.782
95.8178; 116.725; 114.544
9322Xiong, Wei-Wei; Li, Jian-Rong; Hu, Bing; Tan, Bin; Li, Ren-Fu; Huang, Xiao-Ying
Largest discrete supertetrahedral clusters synthesized in ionic liquids
Chemical Science, 2012, 3, 1200
1515032 CIFC97.5 H192 Cl Cu5 Ga30 N24 S53.5P -122.168; 22.846; 24.663
115.174; 111.389; 96.407
9985Xiong, Wei-Wei; Li, Jian-Rong; Hu, Bing; Tan, Bin; Li, Ren-Fu; Huang, Xiao-Ying
Largest discrete supertetrahedral clusters synthesized in ionic liquids
Chemical Science, 2012, 3, 1200
1515033 CIFC108 H210 Cl2 Cu5 In30 N25 S54C 1 2/c 123.617; 40.808; 46.252
90; 94.748; 90
44423Xiong, Wei-Wei; Li, Jian-Rong; Hu, Bing; Tan, Bin; Li, Ren-Fu; Huang, Xiao-Ying
Largest discrete supertetrahedral clusters synthesized in ionic liquids
Chemical Science, 2012, 3, 1200
1515034 CIFC90 H186 Cu5 Ga30 N23 S56P 63/m23.018; 23.018; 42.321
90; 90; 120
19419Xiong, Wei-Wei; Li, Jian-Rong; Hu, Bing; Tan, Bin; Li, Ren-Fu; Huang, Xiao-Ying
Largest discrete supertetrahedral clusters synthesized in ionic liquids
Chemical Science, 2012, 3, 1200

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