Crystallography Open Database

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1516313 CIFC7 H14 F N O20 Si10I 4/m9.1695; 9.1695; 13.344
90; 90; 90
1122Amri, Mahrez; Clarkson, Guy J.; Walton, Richard I.
Anisotropic Thermal Expansion of SiO2and AlPO4Clathrasils with the AST-Type Structure
The Journal of Physical Chemistry C, 2010, 114, 6726
1516318 CIFC25 H16 N4 O4I -4 3 d18.0373; 18.0373; 18.0373
90; 90; 90
5868.3Beaudoin, Daniel; Maris, Thierry; Wuest, James D.
Constructing monocrystalline covalent organic networks by polymerization
Nature Chemistry, 2013, 5, 830-834
1516319 CIFC25 H16 N4 O4P -4 b 213.1545; 13.1545; 7.9818
90; 90; 90
1381.2Beaudoin, Daniel; Maris, Thierry; Wuest, James D.
Constructing monocrystalline covalent organic networks by polymerization
Nature Chemistry, 2013, 5, 830-834
1516320 CIFC24 H16 N4 O4 SiP -4 b 213.421; 13.421; 8.528
90; 90; 90
1536.1Beaudoin, Daniel; Maris, Thierry; Wuest, James D.
Constructing monocrystalline covalent organic networks by polymerization
Nature Chemistry, 2013, 5, 830-834
1516321 CIFC34 H28 N4 O4P 42/n :215.7703; 15.7703; 7.0717
90; 90; 90
1758.75Beaudoin, Daniel; Maris, Thierry; Wuest, James D.
Constructing monocrystalline covalent organic networks by polymerization
Nature Chemistry, 2013, 5, 830-834
1516322 CIFC20 H14 B F2 I O3P 1 21/c 18.2225; 15.7819; 13.9342
90; 94.669; 90
1802.19D’Aléo, Anthony; Heresanu, Vasile; Giorgi, Michel; Le Guennic, Boris; Jacquemin, Denis; Fages, Frédéric
NIR Emission in Borondifluoride Complexes of 2′-Hydroxychalcone Derivatives Containing an Acetonaphthone Ring
The Journal of Physical Chemistry C, 2014, 118, 11906
1516323 CIFC22 H17 B F2 O3P 1 21/c 17.0724; 13.4708; 18.7873
90; 92.283; 90
1788.46D’Aléo, Anthony; Heresanu, Vasile; Giorgi, Michel; Le Guennic, Boris; Jacquemin, Denis; Fages, Frédéric
NIR Emission in Borondifluoride Complexes of 2′-Hydroxychalcone Derivatives Containing an Acetonaphthone Ring
The Journal of Physical Chemistry C, 2014, 118, 11906
1516324 CIFC20 H13 B Br2 F2 O3P 1 21/n 17.4641; 17.7664; 14.5841
90; 101.072; 90
1898D’Aléo, Anthony; Heresanu, Vasile; Giorgi, Michel; Le Guennic, Boris; Jacquemin, Denis; Fages, Frédéric
NIR Emission in Borondifluoride Complexes of 2′-Hydroxychalcone Derivatives Containing an Acetonaphthone Ring
The Journal of Physical Chemistry C, 2014, 118, 11906
1516325 CIFC9 H10 N O3 PP 1 21/n 16.877; 16.165; 8.684
90; 107.06; 90
922.9Kim, Yea Rin; Cho, Seungyoon; Lee, Phil Ho
Metal-Free Azaphosphaannulation of Phosphonamides through Intramolecular Oxidative C-N Bond Formation.
Organic letters, 2014, 16, 3098-3101
1516326 CIFC10 H12 N O3 PP 1 21/c 17.203; 8.501; 17.051
90; 90.9; 90
1044Kim, Yea Rin; Cho, Seungyoon; Lee, Phil Ho
Metal-Free Azaphosphaannulation of Phosphonamides through Intramolecular Oxidative C-N Bond Formation.
Organic letters, 2014, 16, 3098-3101
1516327 CIFC47 H76 P2 Pd SiP 1 21/c 116.1665; 10.3002; 27.3994
90; 102.802; 90
4449.1Suh, Hee-Won; Guard, Louise M.; Hazari, Nilay
A mechanistic study of allene carboxylation with CO2resulting in the development of a Pd(ii) pincer complex for the catalytic hydroboration of CO2
Chemical Science, 2014, 5, 3859
1516328 CIFC47 H76 P2 Pd SiP 1 21/n 114.8954; 18.9114; 16.6032
90; 106.453; 90
4485.5Suh, Hee-Won; Guard, Louise M.; Hazari, Nilay
A mechanistic study of allene carboxylation with CO2resulting in the development of a Pd(ii) pincer complex for the catalytic hydroboration of CO2
Chemical Science, 2014, 5, 3859
1516329 CIFC43 H64 O2 P2 Pd SiP 1 21/n 112.6994; 25.26; 13.3608
90; 105.432; 90
4131.4Suh, Hee-Won; Guard, Louise M.; Hazari, Nilay
A mechanistic study of allene carboxylation with CO2resulting in the development of a Pd(ii) pincer complex for the catalytic hydroboration of CO2
Chemical Science, 2014, 5, 3859
1516330 CIFC39 H60 P2 Pd SiP 1 21/c 19.374; 17.3855; 23.3068
90; 101.572; 90
3721.1Suh, Hee-Won; Guard, Louise M.; Hazari, Nilay
A mechanistic study of allene carboxylation with CO2resulting in the development of a Pd(ii) pincer complex for the catalytic hydroboration of CO2
Chemical Science, 2014, 5, 3859
1516331 CIFC44 H71 Al O2 P2 Pd SiP 1 21/c 110.632; 23.5987; 19.2983
90; 105.726; 90
4660.7Suh, Hee-Won; Guard, Louise M.; Hazari, Nilay
A mechanistic study of allene carboxylation with CO2resulting in the development of a Pd(ii) pincer complex for the catalytic hydroboration of CO2
Chemical Science, 2014, 5, 3859
1516332 CIFC38 H55 F3 O3 P2 Pd S SiP b c a23.517; 21.766; 14.71
90; 90; 90
7530Suh, Hee-Won; Guard, Louise M.; Hazari, Nilay
A mechanistic study of allene carboxylation with CO2resulting in the development of a Pd(ii) pincer complex for the catalytic hydroboration of CO2
Chemical Science, 2014, 5, 3859
1516333 CIFC39 H60 P2 Pd SiP 1 21/c 112.9946; 14.2318; 20.8681
90; 100.188; 90
3798.4Suh, Hee-Won; Guard, Louise M.; Hazari, Nilay
A mechanistic study of allene carboxylation with CO2resulting in the development of a Pd(ii) pincer complex for the catalytic hydroboration of CO2
Chemical Science, 2014, 5, 3859
1516334 CIFC24 H21 Br2 NP 18.187; 9.207; 27.256
90.044; 89.948; 106.384
1971.1Thyrhaug, Erling; Hammershøj, Peter; Kjær, Kasper S; Sørensen, Thomas Just; Harrit, Niels H.; Nielsen, Martin M.; Bechgaard, Klaus
Excited state kinetics of anthracene-bridge-aniline intramolecular exciplexes
Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 1093-1105
1516335 CIFC25 H23 Cl2 NP -18.817; 20.29; 23.921
108.891; 90.992; 91.387
4046.3Thyrhaug, Erling; Hammershøj, Peter; Kjær, Kasper S; Sørensen, Thomas Just; Harrit, Niels H.; Nielsen, Martin M.; Bechgaard, Klaus
Excited state kinetics of anthracene-bridge-aniline intramolecular exciplexes.
Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 1093-1105
1516336 CIFC24 H21 Cl2 NP -18.09; 9.054; 27.394
90; 90; 90
2007Thyrhaug, Erling; Hammershøj, Peter; Kjær, Kasper S; Sørensen, Thomas Just; Harrit, Niels H.; Nielsen, Martin M.; Bechgaard, Klaus
Excited state kinetics of anthracene-bridge-aniline intramolecular exciplexes.
Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 1093-1105
1516337 CIFC24 H22 Br NP -19.285; 10.42; 10.928
67.167; 81.424; 78.925
953.03Thyrhaug, Erling; Hammershøj, Peter; Kjær, Kasper S; Sørensen, Thomas Just; Harrit, Niels H.; Nielsen, Martin M.; Bechgaard, Klaus
Excited state kinetics of anthracene-bridge-aniline intramolecular exciplexes.
Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 1093-1105
1516338 CIFC24 H22 Cl NP -19.298; 10.261; 10.943
66.706; 81.271; 78.544
936.72Thyrhaug, Erling; Hammershøj, Peter; Kjær, Kasper S; Sørensen, Thomas Just; Harrit, Niels H.; Nielsen, Martin M.; Bechgaard, Klaus
Excited state kinetics of anthracene-bridge-aniline intramolecular exciplexes.
Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 1093-1105
1516339 CIFC12 H15 N O3P 1 21 18.4867; 6.5654; 11.1325
90; 108.878; 90
586.92Gietter, Amber A. S.; Gildner, Peter G.; Cinderella, Andrew P.; Watson, Donald A.
General Route for Preparing β-Nitrocarbonyl Compounds Using Copper Thermal Redox Catalysis.
Organic letters, 2014, 16, 3166-3169
1516340 CIFC7 H11 N O4P 21 21 215.8815; 8.9902; 15.9025
90; 90; 90
840.86Gietter, Amber A. S.; Gildner, Peter G.; Cinderella, Andrew P.; Watson, Donald A.
General Route for Preparing β-Nitrocarbonyl Compounds Using Copper Thermal Redox Catalysis.
Organic letters, 2014, 16, 3166-3169
1516341 CIFC14 H29 Cl N2 O3P 1 21/c 18.9297; 13.194; 14.536
90; 98.9222; 90
1691.89Gietter, Amber A. S.; Gildner, Peter G.; Cinderella, Andrew P.; Watson, Donald A.
General Route for Preparing β-Nitrocarbonyl Compounds Using Copper Thermal Redox Catalysis.
Organic letters, 2014, 16, 3166-3169
1516342 CIFC14 H17 Cl2 N2 O3P 1 21/c 114.922; 11.523; 9.548
90; 98.829; 90
1622Gietter, Amber A. S.; Gildner, Peter G.; Cinderella, Andrew P.; Watson, Donald A.
General Route for Preparing β-Nitrocarbonyl Compounds Using Copper Thermal Redox Catalysis.
Organic letters, 2014, 16, 3166-3169
1516343 CIFC19 H24 N2 O2P 1 21/c 113.7462; 11.9167; 12.602
90; 106.292; 90
1981.4Tian, Jingjing; Du, Qiuchen; Guo, Rui; Li, Yun; Cheng, Bin; Zhai, Hongbin
Total synthesis of indole alkaloid (±)-subincanadine e.
Organic letters, 2014, 16, 3173-3175
1516344 CIFC32 H52 N4 O20P 21 21 214.75; 18.89; 10.333
90; 90; 90
927Sikorski, Pawel; Hori, Ritsuko; Wada, Masahisa
Revisit of alpha-chitin crystal structure using high resolution X-ray diffraction data.
Biomacromolecules, 2009, 10, 1100-1105
1516345 CIFC32 H52 N4 O20P 21 21 214.715; 18.77; 10.333
90; 90; 90
914Sikorski, Pawel; Hori, Ritsuko; Wada, Masahisa
Revisit of alpha-chitin crystal structure using high resolution X-ray diffraction data.
Biomacromolecules, 2009, 10, 1100-1105
1516346 CIFBi4 Co0.3 O11 V1.7I 4/m m m3.92; 3.92; 15.5
90; 90; 90
238.179Muller, C.; Anne, M.; Bacmann, M.
Lattice vibrations and order-disorder transition in the oxide anion conductor BICOVOX.15: a neutron thermodiffractometry study
Solid State Ionics, 1998, 111, 27-36
1516347 CIFC9 H8 O2P 1 21/n 15.6283; 17.9569; 7.7399
90; 96.844; 90
776.67Benedict, Jason B.; Coppens, Philip
Kinetics of the single-crystal to single-crystal two-photon photodimerization of alpha-trans-cinnamic acid to alpha-truxillic acid.
The journal of physical chemistry. A, 2009, 113, 3116-3120
1516348 CIFC9 H9 N O4P 21 21 217.6786; 7.7348; 14.8561
90; 90; 90
882.34Nelyubina, Yulia V.; Antipin, Mikhail Yu; Lyssenko, Konstantin A.
Hydrogen bonds between zwitterions: intermediate between classical and charge-assisted ones. A case study.
The journal of physical chemistry. A, 2009, 113, 3615-3620
1516349 CIFC64 H76 Cl2 P4 Pd2C 1 2/c 126.721; 12.755; 21.264
90; 101.51; 90
7101.59Vitaliano, Rosa; Fratoddi, Ilaria; Venditti, Iole; Roviello, Giuseppina; Battocchio, Chiara; Polzonetti, Giovanni; Russo, Maria Vittoria
Self-assembled monolayers based on Pd-containing organometallic thiols: preparation and structural characterization.
The journal of physical chemistry. A, 2009, 113, 14730-14740
1516350 CIFC66 H104 O2 P4 Pd2 S2P -19.847; 13.52; 15.56
94.1; 106.5; 96.2
1963Vitaliano, Rosa; Fratoddi, Ilaria; Venditti, Iole; Roviello, Giuseppina; Battocchio, Chiara; Polzonetti, Giovanni; Russo, Maria Vittoria
Self-assembled monolayers based on Pd-containing organometallic thiols: preparation and structural characterization.
The journal of physical chemistry. A, 2009, 113, 14730-14740
1516351 CIFC28 H60 O2 P2 Pd S2P 18.538; 10.605; 11.064
67.828; 81.864; 85.056
917.8Vitaliano, Rosa; Fratoddi, Ilaria; Venditti, Iole; Roviello, Giuseppina; Battocchio, Chiara; Polzonetti, Giovanni; Russo, Maria Vittoria
Self-assembled monolayers based on Pd-containing organometallic thiols: preparation and structural characterization.
The journal of physical chemistry. A, 2009, 113, 14730-14740
1516352 CIFC22 H27 Cl2 N3 O4P -17.9275; 11.4889; 13.693
71.003; 73.267; 82.75
1128.55Dey, Biswajit; Choudhury, Somnath Ray; Gamez, Patrick; Vargiu, Attilio Vittorio; Robertazzi, Arturo; Chen, Chih-Yuan; Lee, Hon Man; Jana, Atish Dipankar; Mukhopadhyay, Subrata
Water-chloride and water-bromide hydrogen-bonded networks: influence of the nature of the halide ions on the stability of the supramolecular assemblies.
The journal of physical chemistry. A, 2009, 113, 8626-8634
1516353 CIFC22 H27 Br2 N3 O4C 1 2/c 128.4117; 7.9256; 24.8399
90; 124.153; 90
4628.8Dey, Biswajit; Choudhury, Somnath Ray; Gamez, Patrick; Vargiu, Attilio Vittorio; Robertazzi, Arturo; Chen, Chih-Yuan; Lee, Hon Man; Jana, Atish Dipankar; Mukhopadhyay, Subrata
Water-chloride and water-bromide hydrogen-bonded networks: influence of the nature of the halide ions on the stability of the supramolecular assemblies.
The journal of physical chemistry. A, 2009, 113, 8626-8634
1516354 CIFC19 H18 Cl N5 O SP 1 21/c 17.2743; 24.0163; 11.68
90; 110.354; 90
1913.11Guo, Jixi; Liu, Lang; Jia, Dianzeng; Wang, Junhua; Xie, Xiaolin
Solid-state photochromic properties and mechanism of 1-phenyl-3-methyl-4-(3-chlorobenzal)-5-hydroxypyrazole 4-methylthiosemicarbazone.
The journal of physical chemistry. A, 2009, 113, 1255-1258
1516355 CIFC3 H8 N2 OP 21 21 24.979; 10.775; 4.5764
90; 90; 90
245.52Martins, David M. S.; Spanswick, Christopher K.; Middlemiss, Derek S.; Abbas, Nasir; Pulham, Colin R.; Morrison, Carole A.
A new polymorph of N,N'-dimethylurea characterized by X-ray diffraction and first-principles lattice dynamics calculations.
The journal of physical chemistry. A, 2009, 113, 5998-6003
1516356 CIFC55 H49 Eu F18 O8 P2P -112.9551; 15.832; 16.3342
71.639; 70.877; 73.768
2945.6Osawa, Masahisa; Hoshino, Mikio; Wada, Tatsuo; Hayashi, Fumi; Osanai, Shuichi
Intra-complex energy transfer of europium(III) complexes containing anthracene and phenanthrene moieties.
The journal of physical chemistry. A, 2009, 113, 10895-10902
1516357 CIFC55 H49 Eu F18 O8 P2P 1 21/n 115.804; 20.343; 18.9226
90; 96.2858; 90
6047.1Osawa, Masahisa; Hoshino, Mikio; Wada, Tatsuo; Hayashi, Fumi; Osanai, Shuichi
Intra-complex energy transfer of europium(III) complexes containing anthracene and phenanthrene moieties.
The journal of physical chemistry. A, 2009, 113, 10895-10902
1516358 CIFC14 H14 N4 O6P -13.68; 7.595; 12.501
85.69; 88.01; 84.22
346.5Schmidtmann, Marc; Farrugia, Louis J.; Middlemiss, Derek S.; Gutmann, Matthias J.; McIntyre, Garry J.; Wilson, Chick C.
Experimental and theoretical charge density study of polymorphic isonicotinamide-oxalic acid molecular complexes with strong O...H...N hydrogen bonds.
The journal of physical chemistry. A, 2009, 113, 13985-13997
1516359 CIFC14 H14 N4 O6C 1 2/c 111.72; 10.014; 12.187
90; 102.7; 90
1395.3Schmidtmann, Marc; Farrugia, Louis J.; Middlemiss, Derek S.; Gutmann, Matthias J.; McIntyre, Garry J.; Wilson, Chick C.
Experimental and theoretical charge density study of polymorphic isonicotinamide-oxalic acid molecular complexes with strong O...H...N hydrogen bonds.
The journal of physical chemistry. A, 2009, 113, 13985-13997
1516360 CIFC14 H14 N4 O6P -13.6706; 7.6027; 12.478
85.523; 88.193; 84.252
345.31Schmidtmann, Marc; Farrugia, Louis J.; Middlemiss, Derek S.; Gutmann, Matthias J.; McIntyre, Garry J.; Wilson, Chick C.
Experimental and theoretical charge density study of polymorphic isonicotinamide-oxalic acid molecular complexes with strong O...H...N hydrogen bonds.
The journal of physical chemistry. A, 2009, 113, 13985-13997
1516361 CIFC14 H14 N4 O6C 1 2/c 111.668; 9.9799; 12.1407
90; 102.747; 90
1378.89Schmidtmann, Marc; Farrugia, Louis J.; Middlemiss, Derek S.; Gutmann, Matthias J.; McIntyre, Garry J.; Wilson, Chick C.
Experimental and theoretical charge density study of polymorphic isonicotinamide-oxalic acid molecular complexes with strong O...H...N hydrogen bonds.
The journal of physical chemistry. A, 2009, 113, 13985-13997
1516362 CIFC72 H128.5 Co N14 O29 PP 21 21 2115.831; 22.374; 25.304
90; 90; 90
8963Mebs, Stefan; Henn, Julian; Dittrich, Birger; Paulmann, Carsten; Luger, Peter
Electron densities of three B12 vitamins.
The journal of physical chemistry. A, 2009, 113, 8366-8378
1516363 CIFC76 H132 Co N18 O30 PP 21 21 2115.12; 21.474; 27.219
90; 90; 90
8838Mebs, Stefan; Henn, Julian; Dittrich, Birger; Paulmann, Carsten; Luger, Peter
Electron densities of three B12 vitamins.
The journal of physical chemistry. A, 2009, 113, 8366-8378
1516364 CIFC63 H91 Co N13 O28.25 PP 21 21 2117.3; 17.69; 32.23
90; 90; 90
9864Mebs, Stefan; Henn, Julian; Dittrich, Birger; Paulmann, Carsten; Luger, Peter
Electron densities of three B12 vitamins.
The journal of physical chemistry. A, 2009, 113, 8366-8378
1516365 CIFC6 H5 N5 O6P 1 c 17.309; 5.169; 11.583
90; 95.22; 90
435.8Kohno, Yuji; Hiyoshi, Reiko I.; Yamaguchi, Yoshitaka; Matsumoto, Shinya; Koseki, Atsushi; Takahashi, Osamu; Yamasaki, Katsuyoshi; Ueda, Kazuyoshi
Molecular dynamics studies of the structural change in 1,3-diamino-2,4,6-trinitrobenzene (DATB) in the crystalline state under high pressure.
The journal of physical chemistry. A, 2009, 113, 2551-2560
1516366 CIFC8 H5 Mn O3P 1 21/n 110.7512; 6.9258; 11.6465
90; 115.794; 90
780.8Borissova, Alexandra O.; Antipin, Mikhail Yu; Lyssenko, Konstantin A.
Mutual influence of cyclopentadienyl and carbonyl ligands in cymantrene: QTAIM study.
The journal of physical chemistry. A, 2009, 113, 10845-10851
1516367 CIFC12 H18 N4 O8P 1 21/c 17.2459; 20.9361; 9.7928
90; 97.402; 90
1473.2Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi
New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking.
The journal of physical chemistry. A, 2009, 113, 11354-11366
1516368 CIFC12 H18 N4 O8P 1 21/c 17.2445; 20.901; 9.7813
90; 97.413; 90
1468.7Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi
New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking.
The journal of physical chemistry. A, 2009, 113, 11354-11366
1516369 CIFC10 H14 N4 O6P 1 21/n 110.453; 9.464; 12.557
90; 102.551; 90
1212.5Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi
New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking.
The journal of physical chemistry. A, 2009, 113, 11354-11366
1516370 CIFC16 H26 N4 O6P -14.7244; 12.1071; 15.6874
84.553; 87.211; 88.585
892.01Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi
New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking.
The journal of physical chemistry. A, 2009, 113, 11354-11366
1516372 CIFC10 H14 N4 O6P 1 21/n 113.9814; 15.9511; 22.2275
90; 93.019; 90
4950.27Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi
New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking.
The journal of physical chemistry. A, 2009, 113, 11354-11366
1516373 CIFC14 H22 N4 O6P 1 21/n 18.3906; 14.517; 26.835
90; 91.427; 90
3267.7Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi
New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking.
The journal of physical chemistry. A, 2009, 113, 11354-11366
1516374 CIFC22 H32 N4 O6P c a 217.6093; 18.2086; 17.2841
90; 90; 90
2394.8Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi
New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking.
The journal of physical chemistry. A, 2009, 113, 11354-11366
1516375 CIFC14 H22 N4 O6P -14.8071; 10.6331; 16.15
80.715; 83.144; 87.224
808.5Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi
New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking.
The journal of physical chemistry. A, 2009, 113, 11354-11366
1516376 CIFC10 H14 N4 O6P b c a17.4174; 7.0176; 19.344
90; 90; 90
2364.39Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi
New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking.
The journal of physical chemistry. A, 2009, 113, 11354-11366
1516377 CIFC22 H18 N2P b c n12.7108; 7.8485; 34.116
90; 90; 90
3403.4Yang, Jye-Shane; Lin, Cheng-Kai; Lahoti, Anand M.; Tseng, Chung-Kai; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming
Effect of ground-state twisting on the trans –> cis photoisomerization and TICT state formation of aminostilbenes.
The journal of physical chemistry. A, 2009, 113, 4868-4877
1516378 CIFC22 H18 N2P 1 21/n 110.0075; 28.672; 11.7698
90; 97.202; 90
3350.5Yang, Jye-Shane; Lin, Cheng-Kai; Lahoti, Anand M.; Tseng, Chung-Kai; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming
Effect of ground-state twisting on the trans –> cis photoisomerization and TICT state formation of aminostilbenes.
The journal of physical chemistry. A, 2009, 113, 4868-4877
1516379 CIFC22 H18 N2P -19.2398; 9.8013; 19.7269
83.604; 87.026; 70.912
1677.5Yang, Jye-Shane; Lin, Cheng-Kai; Lahoti, Anand M.; Tseng, Chung-Kai; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming
Effect of ground-state twisting on the trans –> cis photoisomerization and TICT state formation of aminostilbenes.
The journal of physical chemistry. A, 2009, 113, 4868-4877
1516380 CIFC23 H20 N2P 1 21/c 116.0282; 13.2482; 8.2983
90; 100.83; 90
1730.72Yang, Jye-Shane; Lin, Cheng-Kai; Lahoti, Anand M.; Tseng, Chung-Kai; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming
Effect of ground-state twisting on the trans –> cis photoisomerization and TICT state formation of aminostilbenes.
The journal of physical chemistry. A, 2009, 113, 4868-4877
1516381 CIFC23 H18 N2P b c a15.7; 6.8425; 33.139
90; 90; 90
3560Yang, Jye-Shane; Lin, Cheng-Kai; Lahoti, Anand M.; Tseng, Chung-Kai; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming
Effect of ground-state twisting on the trans –> cis photoisomerization and TICT state formation of aminostilbenes.
The journal of physical chemistry. A, 2009, 113, 4868-4877
1516382 CIFC23 H18 N2P 1 21/c 17.589; 19.3827; 11.5468
90; 94.827; 90
1692.5Yang, Jye-Shane; Lin, Cheng-Kai; Lahoti, Anand M.; Tseng, Chung-Kai; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming
Effect of ground-state twisting on the trans –> cis photoisomerization and TICT state formation of aminostilbenes.
The journal of physical chemistry. A, 2009, 113, 4868-4877
1516383 CIFC19 H18 Cl2 N4P 1 21 17.6007; 7.3647; 16.11
90; 93.9836; 90
899.61Ma, Yan; Hao, Rui; Shao, Guangsheng; Wang, Yuan
An excellent fluorescent dye with a twistable aromatic chain and its axially chiral crystals.
The journal of physical chemistry. A, 2009, 113, 5066-5072
1516384 CIFC5 H6 N2 O4P 1 21/a 115.77423; 8.07596; 5.00886
90; 111.009; 90
595.671Guidoni, Leonardo; Gontrani, Lorenzo; Bencivenni, Luigi; Sadun, Claudia; Ballirano, Paolo
Overcoming the inadequacy of X-ray powder diffraction in reliable hydrogen location with the aid of first principles calculations: crystal structure determination of orotaldehyde monohydrate.
The journal of physical chemistry. A, 2009, 113, 353-359
1516385 CIFC14 H9 N O3P 1 21/c 111.4213; 12.9119; 7.4058
90; 99.8483; 90
1076.04Chen, Chyi-Lin; Lin, Chun-Wei; Hsieh, Cheng-Chih; Lai, Chin-Hung; Lee, Gene-Hsiang; Wang, Chih-Chieh; Chou, Pi-Tai
Dual excited-state intramolecular proton transfer reaction in 3-hydroxy-2-(pyridin-2-yl)-4H-chromen-4-one.
The journal of physical chemistry. A, 2009, 113, 205-214
1516386 CIFC3 H5 Li O2P 1 21/c 19.609; 4.941; 8.648
90; 94.99; 90
409.03Martínez Casado, F J; Ramos Riesco, M.; García Pérez, M V; Redondo, M. I.; López-Andrés, S; Rodríguez Cheda, J A
Structural and thermodynamic study on short metal alkanoates: lithium propanoate and pentanoate.
The journal of physical chemistry. B, 2009, 113, 12896-12902
1516387 CIFC3 H5 Li O2P 1 21/c 19.823; 4.933; 8.812
90; 96.86; 90
423.94Martínez Casado, F J; Ramos Riesco, M.; García Pérez, M V; Redondo, M. I.; López-Andrés, S; Rodríguez Cheda, J A
Structural and thermodynamic study on short metal alkanoates: lithium propanoate and pentanoate.
The journal of physical chemistry. B, 2009, 113, 12896-12902
1516388 CIFC3 H5 Li O2P 1 21/c 19.646; 4.932; 8.698
90; 95.36; 90
411.99Martínez Casado, F J; Ramos Riesco, M.; García Pérez, M V; Redondo, M. I.; López-Andrés, S; Rodríguez Cheda, J A
Structural and thermodynamic study on short metal alkanoates: lithium propanoate and pentanoate.
The journal of physical chemistry. B, 2009, 113, 12896-12902
1516389 CIFC5 H9 Li O2P 1 21/c 114.181; 4.889; 8.63
90; 95.81; 90
595.3Martínez Casado, F J; Ramos Riesco, M.; García Pérez, M V; Redondo, M. I.; López-Andrés, S; Rodríguez Cheda, J A
Structural and thermodynamic study on short metal alkanoates: lithium propanoate and pentanoate.
The journal of physical chemistry. B, 2009, 113, 12896-12902
1516390 CIFC5 H9 Li O2P 1 21/c 114.358; 4.941; 8.846
90; 93.92; 90
626.1Martínez Casado, F J; Ramos Riesco, M.; García Pérez, M V; Redondo, M. I.; López-Andrés, S; Rodríguez Cheda, J A
Structural and thermodynamic study on short metal alkanoates: lithium propanoate and pentanoate.
The journal of physical chemistry. B, 2009, 113, 12896-12902
1516391 CIFC39 H39 N5 O6P 1 21/c 110.441; 42.197; 8.299
90; 111.46; 90
3402.9Ghosh, Kumaresh; Masanta, Goutam; Fröhlich, Roland; Petsalakis, Ioannis D.; Theodorakopoulos, Giannoula
Triphenylamine-based receptors in selective recognition of dicarboxylic acids.
The journal of physical chemistry. B, 2009, 113, 7800-7809
1516392 CIFC38 H35 Br Cl3 N5 O6P 1 21/n 111.886; 19.507; 16.746
90; 103.22; 90
3779.8Ghosh, Kumaresh; Masanta, Goutam; Fröhlich, Roland; Petsalakis, Ioannis D.; Theodorakopoulos, Giannoula
Triphenylamine-based receptors in selective recognition of dicarboxylic acids.
The journal of physical chemistry. B, 2009, 113, 7800-7809
1516393 CIFC72 H81 N3 O6P -111.39; 12.106; 24.799
103.162; 95.459; 108.054
3114.6Chinta, Jugun Prakash; Acharya, Amitabha; Kumar, Amit; Rao, Chebrolu P.
Spectroscopy and microscopy studies of the recognition of amino acids and aggregation of proteins by Zn(II) complex of lower rim naphthylidene conjugate of calix[4]arene.
The journal of physical chemistry. B, 2009, 113, 12075-12083
1516394 CIFC92 H156 Br Cl N30 O53P -114.97; 15.11; 29.968
104.6; 102.7; 90
6388Fedorova, Olga A.; Chernikova, Ekaterina Yu; Fedorov, Yuri V.; Gulakova, Elena N.; Peregudov, Aleksander S.; Lyssenko, Konstantin A.; Jonusauskas, Gediminas; Isaacs, Lyle
Cucurbit[7]uril complexes of crown-ether derived styryl and (bis)styryl dyes.
The journal of physical chemistry. B, 2009, 113, 10149-10158
1516395 CIFC6 H6 Eu O9P n n m13.4361; 6.625; 10.1416
90; 90; 90
902.75Rodrigues, Marcelo O.; Paz, Filipe A Almeida; Freire, Ricardo O.; de Sá, Gilberto F; Galembeck, André; Montenegro, Maria C. B. S. M.; Araújo, Alberto N; Alves, S.
Modeling, structural, and spectroscopic studies of lanthanide-organic frameworks.
The journal of physical chemistry. B, 2009, 113, 12181-12188
1516396 CIFC6 H6 Gd O9P n n m13.3662; 6.5897; 10.1045
90; 90; 90
890Rodrigues, Marcelo O.; Paz, Filipe A Almeida; Freire, Ricardo O.; de Sá, Gilberto F; Galembeck, André; Montenegro, Maria C. B. S. M.; Araújo, Alberto N; Alves, S.
Modeling, structural, and spectroscopic studies of lanthanide-organic frameworks.
The journal of physical chemistry. B, 2009, 113, 12181-12188
1516397 CIFC6 H6 O9 TbP n n m13.341; 6.5718; 10.0912
90; 90; 90
884.74Rodrigues, Marcelo O.; Paz, Filipe A Almeida; Freire, Ricardo O.; de Sá, Gilberto F; Galembeck, André; Montenegro, Maria C. B. S. M.; Araújo, Alberto N; Alves, S.
Modeling, structural, and spectroscopic studies of lanthanide-organic frameworks.
The journal of physical chemistry. B, 2009, 113, 12181-12188
1516398 CIFC21 H15 N6 Ni S4P 1 21/c 112.137; 26.69; 7.526
90; 103.896; 90
2366.6Tian, Zhengfang; Duan, Haibao; Ren, Xiaoming; Lu, Changsheng; Li, Yizhi; Song, You; Zhu, Huizhen; Meng, Qingjin
Two spin-peierls-like compounds exhibiting divergent structural features, lattice compression, and expansion in the low- temperature phase.
The journal of physical chemistry. B, 2009, 113, 8278-8283
1516399 CIFC21 H14 N5 Ni S4P 1 21/c 112.123; 26.446; 7.389
90; 103.168; 90
2306.7Tian, Zhengfang; Duan, Haibao; Ren, Xiaoming; Lu, Changsheng; Li, Yizhi; Song, You; Zhu, Huizhen; Meng, Qingjin
Two spin-peierls-like compounds exhibiting divergent structural features, lattice compression, and expansion in the low- temperature phase.
The journal of physical chemistry. B, 2009, 113, 8278-8283
1516400 CIFC21 H14 N5 Ni S4P -17.239; 12.109; 26.347
88.629; 86.36; 76.992
2245.6Tian, Zhengfang; Duan, Haibao; Ren, Xiaoming; Lu, Changsheng; Li, Yizhi; Song, You; Zhu, Huizhen; Meng, Qingjin
Two spin-peierls-like compounds exhibiting divergent structural features, lattice compression, and expansion in the low- temperature phase.
The journal of physical chemistry. B, 2009, 113, 8278-8283
1516401 CIFC21 H15 N6 Ni S4P -17.311; 12.252; 28.68
91.557; 92.682; 104.625
2481Tian, Zhengfang; Duan, Haibao; Ren, Xiaoming; Lu, Changsheng; Li, Yizhi; Song, You; Zhu, Huizhen; Meng, Qingjin
Two spin-peierls-like compounds exhibiting divergent structural features, lattice compression, and expansion in the low- temperature phase.
The journal of physical chemistry. B, 2009, 113, 8278-8283
1516402 CIFC10 H18 Cl3 Eu N2 O5P -16.9602; 11.046; 11.432
89.2875; 85.9659; 75.6017
849.19Puntus, Lada N.; Lyssenko, Konstantin A.; Pekareva, Irina S.; Bünzli, Jean-Claude G
Intermolecular interactions as actors in energy-transfer processes in lanthanide complexes with 2,2'-bipyridine.
The journal of physical chemistry. B, 2009, 113, 9265-9277
1516403 CIFC10 H18 Cl3 N2 O5 TbP -16.9347; 10.9975; 11.4293
89.275; 85.846; 75.644
842.2Puntus, Lada N.; Lyssenko, Konstantin A.; Pekareva, Irina S.; Bünzli, Jean-Claude G
Intermolecular interactions as actors in energy-transfer processes in lanthanide complexes with 2,2'-bipyridine.
The journal of physical chemistry. B, 2009, 113, 9265-9277
1516404 CIFC20 H38.3 Cl6 Eu2 N4 O11.15P -18.0772; 9.4719; 24.046
86.23; 87.6618; 75.2674
1774.79Puntus, Lada N.; Lyssenko, Konstantin A.; Pekareva, Irina S.; Bünzli, Jean-Claude G
Intermolecular interactions as actors in energy-transfer processes in lanthanide complexes with 2,2'-bipyridine.
The journal of physical chemistry. B, 2009, 113, 9265-9277
1516405 CIFC20 H38.3 Cl6 N4 O11.15 Tb2P -18.0501; 9.4525; 23.9554
86.419; 87.878; 75.301
1759.33Puntus, Lada N.; Lyssenko, Konstantin A.; Pekareva, Irina S.; Bünzli, Jean-Claude G
Intermolecular interactions as actors in energy-transfer processes in lanthanide complexes with 2,2'-bipyridine.
The journal of physical chemistry. B, 2009, 113, 9265-9277
1516406 CIFC20 H20 Cl3 Eu N4 O2C 1 2/c 115.6601; 11.3228; 13.9002
90; 117.066; 90
2194.8Puntus, Lada N.; Lyssenko, Konstantin A.; Pekareva, Irina S.; Bünzli, Jean-Claude G
Intermolecular interactions as actors in energy-transfer processes in lanthanide complexes with 2,2'-bipyridine.
The journal of physical chemistry. B, 2009, 113, 9265-9277
1516407 CIFC20 H26 Cl3 N4 O5 TbP 1 21/n 117.0971; 9.2782; 17.1306
90; 116.493; 90
2432.1Puntus, Lada N.; Lyssenko, Konstantin A.; Pekareva, Irina S.; Bünzli, Jean-Claude G
Intermolecular interactions as actors in energy-transfer processes in lanthanide complexes with 2,2'-bipyridine.
The journal of physical chemistry. B, 2009, 113, 9265-9277
1516408 CIFC20 H22 Cl3 Eu N4 O3P -17.4596; 17.774; 19.394
66.106; 88.232; 83.116
2333.6Puntus, Lada N.; Lyssenko, Konstantin A.; Pekareva, Irina S.; Bünzli, Jean-Claude G
Intermolecular interactions as actors in energy-transfer processes in lanthanide complexes with 2,2'-bipyridine.
The journal of physical chemistry. B, 2009, 113, 9265-9277
1516409 CIFC22.5 H28.24 Cl3 Eu N4 O3.62I 2 325.8471; 25.8471; 25.8471
90; 90; 90
17268Puntus, Lada N.; Lyssenko, Konstantin A.; Pekareva, Irina S.; Bünzli, Jean-Claude G
Intermolecular interactions as actors in energy-transfer processes in lanthanide complexes with 2,2'-bipyridine.
The journal of physical chemistry. B, 2009, 113, 9265-9277
1516410 CIFC20 H24 Cl2 Cu N4 O6P 21 21 216.6825; 16.2052; 20.21
90; 90; 90
2188.6Offenbacher, Adam; White, Kimberly N.; Sen, Indranil; Oliver, Allen G.; Konopelski, Joseph P.; Barry, Bridgette A.; Einarsdóttir, Olöf
A spectroscopic investigation of a tridentate Cu-complex mimicking the tyrosine-histidine cross-link of cytochrome C oxidase.
The journal of physical chemistry. B, 2009, 113, 7407-7417
1516411 CIFC6 H5 N O3P -16.976; 11.231; 16.29
82.55; 78.279; 75.166
1203.9Santos, Rui C.; Figueira, Rita M. B. B. M.; Piedade, M Fátima M; Diogo, Hermínio P; Minas da Piedade, Manuel E.
Energetics and structure of hydroxynicotinic acids. Crystal structures of 2-, 4-, 6-hydroxynicotinic and 5-chloro-6-hydroxynicotinic acids.
The journal of physical chemistry. B, 2009, 113, 14291-14309
1516412 CIFC6 H4 Cl N O3P 1 21/c 15.469; 10.529; 11.795
90; 97.72; 90
673Santos, Rui C.; Figueira, Rita M. B. B. M.; Piedade, M Fátima M; Diogo, Hermínio P; Minas da Piedade, Manuel E.
Energetics and structure of hydroxynicotinic acids. Crystal structures of 2-, 4-, 6-hydroxynicotinic and 5-chloro-6-hydroxynicotinic acids.
The journal of physical chemistry. B, 2009, 113, 14291-14309
1516413 CIFC6 H5 N O3P 1 21/n 13.797; 7.354; 20.905
90; 90.007; 90
583.7Santos, Rui C.; Figueira, Rita M. B. B. M.; Piedade, M Fátima M; Diogo, Hermínio P; Minas da Piedade, Manuel E.
Energetics and structure of hydroxynicotinic acids. Crystal structures of 2-, 4-, 6-hydroxynicotinic and 5-chloro-6-hydroxynicotinic acids.
The journal of physical chemistry. B, 2009, 113, 14291-14309
1516414 CIFC6 H5 N O3P 1 21/c 13.804; 14.582; 10.673
90; 94.254; 90
590.4Santos, Rui C.; Figueira, Rita M. B. B. M.; Piedade, M Fátima M; Diogo, Hermínio P; Minas da Piedade, Manuel E.
Energetics and structure of hydroxynicotinic acids. Crystal structures of 2-, 4-, 6-hydroxynicotinic and 5-chloro-6-hydroxynicotinic acids.
The journal of physical chemistry. B, 2009, 113, 14291-14309
1516415 CIFC7 H14 F6 N2 O5 S2P n a 219.657; 11.141; 14.651
90; 90; 90
1576Nockemann, Peter; Binnemans, Koen; Thijs, Ben; Parac-Vogt, Tatjana N; Merz, Klaus; Mudring, Anja-Verena; Menon, Preethy Chirukandath; Rajesh, Ravindran Nair; Cordoyiannis, George; Thoen, Jan; Leys, Jan; Glorieux, Christ
Temperature-driven mixing-demixing behavior of binary mixtures of the ionic liquid choline bis(trifluoromethylsulfonyl)imide and water.
The journal of physical chemistry. B, 2009, 113, 1429-1437
1516416 CIFC23 H125 N O41P -6 m 212.15; 12.15; 12.58
90; 90; 120
1608.3Terekhova, Irina S.; Manakov, Andrey Yu; Soldatov, Dmitriy V.; Suwinska, Kinga; Skiba, Sergey S.; Stenin, Yuri G.; Villevald, Galina V.; Karpova, Tamara D.; Yunoshev, Alexander S.
Calorimetric and X-ray studies of clathrate hydrates of tetraisoamylammonium polyacrylates.
The journal of physical chemistry. B, 2009, 113, 5760-5768
1516417 CIFC54 H78 I2 N26 O20P 1 21/n 111.8818; 24.8098; 22.2737
90; 92.249; 90
6560.9Khan, Muhammad S. A.; Heger, Dominik; Necas, Marek; Sindelar, Vladimir
Remarkable salt effect on stability of supramolecular complex between modified cucurbit[6]uril and methylviologen in aqueous media.
The journal of physical chemistry. B, 2009, 113, 11054-11057
1516418 CIFC45 H92 N24 O32P -111.649; 16.574; 17.187
90.1; 102.57; 98.12
3204Khan, Muhammad S. A.; Heger, Dominik; Necas, Marek; Sindelar, Vladimir
Remarkable salt effect on stability of supramolecular complex between modified cucurbit[6]uril and methylviologen in aqueous media.
The journal of physical chemistry. B, 2009, 113, 11054-11057
1516419 CIFC24 H12 F6 O2 S2C m c a6.844; 22.211; 13.877
90; 90; 90
2109Ie, Yutaka; Nitani, Masashi; Uemura, Takafumi; Tominari, Yukihiro; Takeya, Jun; Honsho, Yoshihito; Saeki, Akinori; Seki, Shu; Aso, Yoshio
Comprehensive Evaluation of Electron Mobility for a Trifluoroacetyl-Terminated Electronegative Conjugated Oligomer
The Journal of Physical Chemistry C, 2009, 113, 17189
1516420 CIFC30 H22P 1 21/n 15.25; 9.4591; 20.734
90; 90.7; 90
1029.6He, Jiating; Xu, Bin; Chen, Feipeng; Xia, Haijian; Li, Kunpeng; Ye, Ling; Tian, Wenjing
Aggregation-Induced Emission in the Crystals of 9,10-Distyrylanthracene Derivatives: The Essential Role of Restricted Intramolecular Torsion
The Journal of Physical Chemistry C, 2009, 113, 9892
1516421 CIFC38 H38 O2P -19.5989; 12.563; 14.354
110.05; 107.52; 99.46
1479.8He, Jiating; Xu, Bin; Chen, Feipeng; Xia, Haijian; Li, Kunpeng; Ye, Ling; Tian, Wenjing
Aggregation-Induced Emission in the Crystals of 9,10-Distyrylanthracene Derivatives: The Essential Role of Restricted Intramolecular Torsion
The Journal of Physical Chemistry C, 2009, 113, 9892
1516422 CIFC38 H38 O2P 1 21/c 19.2404; 8.6917; 18.711
90; 97.04; 90
1491.4He, Jiating; Xu, Bin; Chen, Feipeng; Xia, Haijian; Li, Kunpeng; Ye, Ling; Tian, Wenjing
Aggregation-Induced Emission in the Crystals of 9,10-Distyrylanthracene Derivatives: The Essential Role of Restricted Intramolecular Torsion
The Journal of Physical Chemistry C, 2009, 113, 9892
1516423 CIFC32 H26 O2P -16.9598; 8.8751; 10.465
101.5; 99.17; 105.19
595.8He, Jiating; Xu, Bin; Chen, Feipeng; Xia, Haijian; Li, Kunpeng; Ye, Ling; Tian, Wenjing
Aggregation-Induced Emission in the Crystals of 9,10-Distyrylanthracene Derivatives: The Essential Role of Restricted Intramolecular Torsion
The Journal of Physical Chemistry C, 2009, 113, 9892
1516424 CIFH4 Li2.79 Mg2.66 N4I -4 2 m5.12981; 5.12981; 9.6191
90; 90; 90
253.13Weidner, Eveline; Dolci, Francesco; Hu, Jianjiang; Lohstroh, Wiebke; Hansen, Thomas; Bull, Daniel J.; Fichtner, Maximilian
Hydrogenation Reaction Pathway in Li2Mg(NH)2
The Journal of Physical Chemistry C, 2009, 113, 15772
1516425 CIFC23 H33 N SC 1 2/c 138.898; 6.1786; 19.3956
90; 112.449; 90
4308.2Bourque, Alex N.; Dufresne, Stéphane; Skene, W. G.
Thiophene-Phenyl Azomethines with Varying Rotational Barriers - Model Compounds for Examining Imine Fluorescence Deactivation
The Journal of Physical Chemistry C, 2009, 113, 19677
1516426 CIFC166 H64 N12 Ni2C 1 2/c 136.842; 14.498; 24.607
90; 115.396; 90
11873Nobukuni, Hirofumi; Tani, Fumito; Shimazaki, Yuichi; Naruta, Yoshinori; Ohkubo, Kei; Nakanishi, Tatsuaki; Kojima, Takahiko; Fukuzumi, Shunichi; Seki, Shu
Anisotropic High Electron Mobility and Photodynamics of a Self-Assembled Porphyrin Nanotube Including C60Molecules
The Journal of Physical Chemistry C, 2009, 113, 19694
1516427 CIFC21 H21 N SiP c c n19.1697; 21.281; 9.166
90; 90; 90
3739.3Han, Won-Sik; Son, Ho-Jin; Wee, Kyung-Ryang; Min, Kyoung-Tae; Kwon, Soonnam; Suh, Il-Hwan; Choi, Seung-Hoon; Jung, Dong Hyun; Kang, Sang Ook
Silicon-Based Blue Phosphorescence Host Materials: Structure and Photophysical Property Relationship on Methyl/Phenylsilanes Adorned with 4-(N-Carbazolyl)phenyl Groups and Optimization of Their Electroluminescence by Peripheral 4-(N-Carbazolyl)phenyl Numbers
The Journal of Physical Chemistry C, 2009, 113, 19686
1516428 CIFC38 H30 N2 SiP -18.4321; 12.7787; 13.8467
88.084; 81.072; 80.929
1455.4Han, Won-Sik; Son, Ho-Jin; Wee, Kyung-Ryang; Min, Kyoung-Tae; Kwon, Soonnam; Suh, Il-Hwan; Choi, Seung-Hoon; Jung, Dong Hyun; Kang, Sang Ook
Silicon-Based Blue Phosphorescence Host Materials: Structure and Photophysical Property Relationship on Methyl/Phenylsilanes Adorned with 4-(N-Carbazolyl)phenyl Groups and Optimization of Their Electroluminescence by Peripheral 4-(N-Carbazolyl)phenyl Numbers
The Journal of Physical Chemistry C, 2009, 113, 19686
1516429 CIFC56 H36 Cl2 N3 SiP 1 21/c 115.3044; 20.9557; 14.1004
90; 97.804; 90
4480.3Han, Won-Sik; Son, Ho-Jin; Wee, Kyung-Ryang; Min, Kyoung-Tae; Kwon, Soonnam; Suh, Il-Hwan; Choi, Seung-Hoon; Jung, Dong Hyun; Kang, Sang Ook
Silicon-Based Blue Phosphorescence Host Materials: Structure and Photophysical Property Relationship on Methyl/Phenylsilanes Adorned with 4-(N-Carbazolyl)phenyl Groups and Optimization of Their Electroluminescence by Peripheral 4-(N-Carbazolyl)phenyl Numbers
The Journal of Physical Chemistry C, 2009, 113, 19686
1516430 CIFC72 H48 N4 SiP -18.2688; 13.798; 23.516
79.314; 80.893; 81.98
2586.4Han, Won-Sik; Son, Ho-Jin; Wee, Kyung-Ryang; Min, Kyoung-Tae; Kwon, Soonnam; Suh, Il-Hwan; Choi, Seung-Hoon; Jung, Dong Hyun; Kang, Sang Ook
Silicon-Based Blue Phosphorescence Host Materials: Structure and Photophysical Property Relationship on Methyl/Phenylsilanes Adorned with 4-(N-Carbazolyl)phenyl Groups and Optimization of Their Electroluminescence by Peripheral 4-(N-Carbazolyl)phenyl Numbers
The Journal of Physical Chemistry C, 2009, 113, 19686
1516431 CIFC36 H27 N SiP 1 21 112.622; 7.267; 16.01
90; 110.752; 90
1373Han, Won-Sik; Son, Ho-Jin; Wee, Kyung-Ryang; Min, Kyoung-Tae; Kwon, Soonnam; Suh, Il-Hwan; Choi, Seung-Hoon; Jung, Dong Hyun; Kang, Sang Ook
Silicon-Based Blue Phosphorescence Host Materials: Structure and Photophysical Property Relationship on Methyl/Phenylsilanes Adorned with 4-(N-Carbazolyl)phenyl Groups and Optimization of Their Electroluminescence by Peripheral 4-(N-Carbazolyl)phenyl Numbers
The Journal of Physical Chemistry C, 2009, 113, 19686
1516432 CIFC48 H34 N2 SiC 1 2/c 117.632; 20.248; 30.81
90; 101.527; 90
10778Han, Won-Sik; Son, Ho-Jin; Wee, Kyung-Ryang; Min, Kyoung-Tae; Kwon, Soonnam; Suh, Il-Hwan; Choi, Seung-Hoon; Jung, Dong Hyun; Kang, Sang Ook
Silicon-Based Blue Phosphorescence Host Materials: Structure and Photophysical Property Relationship on Methyl/Phenylsilanes Adorned with 4-(N-Carbazolyl)phenyl Groups and Optimization of Their Electroluminescence by Peripheral 4-(N-Carbazolyl)phenyl Numbers
The Journal of Physical Chemistry C, 2009, 113, 19686
1516433 CIFC30 H20 N2P 21 21 219.0748; 12.493; 19.025
90; 90; 90
2156.9Han, Won-Sik; Son, Ho-Jin; Wee, Kyung-Ryang; Min, Kyoung-Tae; Kwon, Soonnam; Suh, Il-Hwan; Choi, Seung-Hoon; Jung, Dong Hyun; Kang, Sang Ook
Silicon-Based Blue Phosphorescence Host Materials: Structure and Photophysical Property Relationship on Methyl/Phenylsilanes Adorned with 4-(N-Carbazolyl)phenyl Groups and Optimization of Their Electroluminescence by Peripheral 4-(N-Carbazolyl)phenyl Numbers
The Journal of Physical Chemistry C, 2009, 113, 19686
1516434 CIFB12 H12 Na2P 1 21/n 17.03062; 10.65399; 7.0093
90; 94.6759; 90
523.28Her, Jae-Hyuk; Zhou, Wei; Stavila, Vitalie; Brown, Craig M.; Udovic, Terrence J.
Role of Cation Size on the Structural Behavior of the Alkali-Metal Dodecahydro-closo-Dodecaborates
The Journal of Physical Chemistry C, 2009, 113, 11187
1516435 CIFC32 H28 B F2 N2P -16.7344; 13.4028; 14.985
74.755; 84.053; 76.716
1268.7Hu, Rongrong; Lager, Erik; Aguilar-Aguilar, Angélica; Liu, Jianzhao; Lam, Jacky W. Y.; Sung, Herman H. Y.; Williams, Ian D.; Zhong, Yongchun; Wong, Kam Sing; Peña-Cabrera, Eduardo; Tang, Ben Zhong
Twisted Intramolecular Charge Transfer and Aggregation-Induced Emission of BODIPY Derivatives
The Journal of Physical Chemistry C, 2009, 113, 15845
1516436 CIFC27 H20 B F2 N3P 1 21/c 113.1915; 13.6706; 12.3036
90; 106.822; 90
2123.8Hu, Rongrong; Lager, Erik; Aguilar-Aguilar, Angélica; Liu, Jianzhao; Lam, Jacky W. Y.; Sung, Herman H. Y.; Williams, Ian D.; Zhong, Yongchun; Wong, Kam Sing; Peña-Cabrera, Eduardo; Tang, Ben Zhong
Twisted Intramolecular Charge Transfer and Aggregation-Induced Emission of BODIPY Derivatives
The Journal of Physical Chemistry C, 2009, 113, 15845
1516437 CIFC33 H34 Br N2 O10 ReP -112.019; 12.068; 13.281
109.45; 105.58; 93.4
1726.1Yam, Vivian Wing-Wah; Song, Hai-Ou; Chan, Steve Tak-Wah; Zhu, Nianyong; Tao, Chi-Hang; Wong, Keith Man-Chung; Wu, Li-Xin
Synthesis, Characterization, Ion-Binding Properties, and Fluorescence Resonance Energy Transfer Behavior of Rhenium(I) Complexes Containing a Coumarin-Appended 2,2′-Bipyridine†
The Journal of Physical Chemistry C, 2009, 113, 11674
1516438 CIFC13 H13 N3 O3 SC 1 2/c 129.3274; 6.97802; 16.074
90; 121.103; 90
2816.61Tohnai, Norimitsu; Kurata, Mitsuru; Nakajima, Hiromi; Yamamoto, Atsushi; Hinoue, Tomoaki; Mizobe, Yuji; Hisaki, Ichiro; Miyata, Mikiji
Effect of Steric Complementarity on Solid-State Optical Properties of Ternary CT Complexes: 4,4′-Biphenyldisulfonic Acid, Aliphatic Amines, and Tetracyanoquinodimethane†
The Journal of Physical Chemistry C, 2009, 113, 11725
1516439 CIFC14 H13 N3 O3 SC 1 2/c 129.7095; 7.07728; 16.852
90; 122.519; 90
2987.79Tohnai, Norimitsu; Kurata, Mitsuru; Nakajima, Hiromi; Yamamoto, Atsushi; Hinoue, Tomoaki; Mizobe, Yuji; Hisaki, Ichiro; Miyata, Mikiji
Effect of Steric Complementarity on Solid-State Optical Properties of Ternary CT Complexes: 4,4′-Biphenyldisulfonic Acid, Aliphatic Amines, and Tetracyanoquinodimethane†
The Journal of Physical Chemistry C, 2009, 113, 11725
1516440 CIFC16 H18 N3 O3 SC 1 2/c 130.9476; 6.97466; 17.6192
90; 121.616; 90
3238.63Tohnai, Norimitsu; Kurata, Mitsuru; Nakajima, Hiromi; Yamamoto, Atsushi; Hinoue, Tomoaki; Mizobe, Yuji; Hisaki, Ichiro; Miyata, Mikiji
Effect of Steric Complementarity on Solid-State Optical Properties of Ternary CT Complexes: 4,4′-Biphenyldisulfonic Acid, Aliphatic Amines, and Tetracyanoquinodimethane†
The Journal of Physical Chemistry C, 2009, 113, 11725
1516441 CIFC15 H13 N3 O3 SP -17.0287; 8.6449; 13.1179
93.794; 99.168; 100.054
771.18Tohnai, Norimitsu; Kurata, Mitsuru; Nakajima, Hiromi; Yamamoto, Atsushi; Hinoue, Tomoaki; Mizobe, Yuji; Hisaki, Ichiro; Miyata, Mikiji
Effect of Steric Complementarity on Solid-State Optical Properties of Ternary CT Complexes: 4,4′-Biphenyldisulfonic Acid, Aliphatic Amines, and Tetracyanoquinodimethane†
The Journal of Physical Chemistry C, 2009, 113, 11725
1516442 CIFC48 H39 B Cu F4 N3 O P2 SP -112.3282; 12.4191; 17.625
70.167; 78; 68.64
2353.1Zhang, Liming; Li, Bin; Su, Zhongmin
Realization of High-Energy Emission from [Cu(N−N)(P−P)]+Complexes for Organic Light-Emitting Diode Applications
The Journal of Physical Chemistry C, 2009, 113, 13968
1516443 CIFC48 H37 B Cu F4 N3 O P2P 1 21/n 111.5602; 15.13; 25.815
90; 96.195; 90
4488.8Zhang, Liming; Li, Bin; Su, Zhongmin
Realization of High-Energy Emission from [Cu(N−N)(P−P)]+Complexes for Organic Light-Emitting Diode Applications
The Journal of Physical Chemistry C, 2009, 113, 13968
1516444 CIFC10 H38 Cl3 La O15P 21 21 2110.7084; 15.3419; 15.984
90; 90; 90
2626Lindqvist-Reis, Patric; Walther, Clemens; Klenze, Reinhardt; Edelstein, Norman M.
Optical Spectra and Crystal-Field Levels of [Cm(H2O)9]3+Ions withC3hSymmetry in Isotypic Rare-Earth Triflate and Ethyl Sulfate Salts
The Journal of Physical Chemistry C, 2009, 113, 449
1516445 CIFC96 H112 Cl6 Cu3 N24 O23.6P -19.1548; 14.876; 22.3887
78.557; 84.283; 81.915
2950.64Piepenbrock, Marc-Oliver M.; Clarke, Nigel; Steed, Jonathan W.
Metal Ion and Anion-Based “Tuning” of a Supramolecular Metallogel†
Langmuir, 2009, 25, 8451
1516446 CIFC50 H68 Cu N14 O14P -18.9533; 9.5321; 16.993
76.234; 86.011; 84.48
1400.4Piepenbrock, Marc-Oliver M.; Clarke, Nigel; Steed, Jonathan W.
Metal Ion and Anion-Based “Tuning” of a Supramolecular Metallogel†
Langmuir, 2009, 25, 8451
1516447 CIFC15 H10 Cl2 N4 O2P -16.9301; 7.9168; 14.3648
101.341; 101.8; 92.392
753.63Wackerly, Jay Wm.; Meyer, Joseph M.; Crannell, W. Christian; King, Sarah B.; Katz, Jeffrey L.
Selective Synthesis of Poly(m-phenylene oxides) over Oxacalixarenes
Macromolecules, 2009, 42, 8181
1516448 CIFC15 H10 Cl2 N4 O2C 1 2/c 116.219; 14.7254; 6.6795
90; 106.412; 90
1530.3Wackerly, Jay Wm.; Meyer, Joseph M.; Crannell, W. Christian; King, Sarah B.; Katz, Jeffrey L.
Selective Synthesis of Poly(m-phenylene oxides) over Oxacalixarenes
Macromolecules, 2009, 42, 8181
1516449 CIFC27 H38 B F4 N O0.5 P RhP -19.4341; 9.8954; 14.835
92.365; 107.922; 95.181
1308.84Jiménez, M. Victoria; Pérez-Torrente, Jesús J.; Bartolomé, M. Isabel; Vispe, Eugenio; Lahoz, Fernando J.; Oro, Luis A.
Cationic Rhodium Complexes with Hemilabile Phosphine Ligands as Polymerization Catalyst for High Molecular Weight Stereoregular Poly(phenylacetylene)
Macromolecules, 2009, 42, 8146
1516450 CIFC30 H29 B Cl3 F8 N P RhP 1 21/n 112.355; 19.72; 12.934
90; 93.83; 90
3144.2Jiménez, M. Victoria; Pérez-Torrente, Jesús J.; Bartolomé, M. Isabel; Vispe, Eugenio; Lahoz, Fernando J.; Oro, Luis A.
Cationic Rhodium Complexes with Hemilabile Phosphine Ligands as Polymerization Catalyst for High Molecular Weight Stereoregular Poly(phenylacetylene)
Macromolecules, 2009, 42, 8146
1516451 CIFC42 H58 N2 O2 Si2C 1 c 126.914; 9.765; 16.289
90; 109.311; 90
4040.1Salata, Michael R.; Marks, Tobin J.
Catalyst Nuclearity Effects in Olefin Polymerization. Enhanced Activity and Comonomer Enchainment in Ethylene + Olefin Copolymerizations Mediated by Bimetallic Group 4 Phenoxyiminato Catalysts
Macromolecules, 2009, 42, 1920
1516452 CIFC36 H42 N2 O2P 1 21/c 110.0592; 23.0731; 13.9928
90; 109.435; 90
3062.6Salata, Michael R.; Marks, Tobin J.
Catalyst Nuclearity Effects in Olefin Polymerization. Enhanced Activity and Comonomer Enchainment in Ethylene + Olefin Copolymerizations Mediated by Bimetallic Group 4 Phenoxyiminato Catalysts
Macromolecules, 2009, 42, 1920
1516453 CIFC48 H50 N8 O5P c c n30.312; 20.567; 6.777
90; 90; 90
4225Ono, Katsuhiko; Tsukamoto, Kenichi; Hosokawa, Ryohei; Kato, Masaki; Suganuma, Motohiro; Tomura, Masaaki; Sako, Katsuya; Taga, Keijiro; Saito, Katsuhiro
A linear chain of water molecules accommodated in a macrocyclic nanotube channel.
Nano letters, 2009, 9, 122-125
1516456 CIFCa3 Cl2 O4 SiP 1 21/c 15.912339; 10.201282; 10.988655
90; 90.3422; 90
662.752Kim, Tae-Gon; Kim, Taehyung; Kim, Jaegyeom; Kim, Seung-Joo; Im, Seoung-Jae
Interplay between Crystal Structure and Photoluminescence Properties of β-Ca3SiO4Cl2:Eu2+
The Journal of Physical Chemistry C, 2014, 118, 12428
1516457 CIFC14 H19 N O2 SP 1 21 17.3662; 17.2624; 11.3119
90; 107.957; 90
1368.33Hirner, Sebastian; Kolb, Andreas; Westmeier, Johannes; Gebhardt, Sandra; Middel, Stephen; Harms, Klaus; von Zezschwitz, Paultheo
Rhodium-catalyzed enantioselective addition of organoaluminum reagents to N-tosyl ketimines.
Organic letters, 2014, 16, 3162-3165
1516458 CIFC15 H21 N O2 SP 21 21 217.6766; 17.0877; 22.6809
90; 90; 90
2975.2Hirner, Sebastian; Kolb, Andreas; Westmeier, Johannes; Gebhardt, Sandra; Middel, Stephen; Harms, Klaus; von Zezschwitz, Paultheo
Rhodium-catalyzed enantioselective addition of organoaluminum reagents to N-tosyl ketimines.
Organic letters, 2014, 16, 3162-3165
1516459 CIFC19 H21 N O2 SP 21 21 219.7947; 9.9666; 16.9986
90; 90; 90
1659.4Hirner, Sebastian; Kolb, Andreas; Westmeier, Johannes; Gebhardt, Sandra; Middel, Stephen; Harms, Klaus; von Zezschwitz, Paultheo
Rhodium-catalyzed enantioselective addition of organoaluminum reagents to N-tosyl ketimines.
Organic letters, 2014, 16, 3162-3165
1516460 CIFC15 H23 N O2 SP 1 21 110.2019; 13.2716; 11.3946
90; 100.893; 90
1515Hirner, Sebastian; Kolb, Andreas; Westmeier, Johannes; Gebhardt, Sandra; Middel, Stephen; Harms, Klaus; von Zezschwitz, Paultheo
Rhodium-catalyzed enantioselective addition of organoaluminum reagents to N-tosyl ketimines.
Organic letters, 2014, 16, 3162-3165
1516461 CIFC29 H23 N5 O2 SP -19.4716; 10.8769; 11.9856
83.113; 83.385; 87.083
1216.8Tokimizu, Yusuke; Oishi, Shinya; Fujii, Nobutaka; Ohno, Hiroaki
Gold-Catalyzed Cascade Cyclization of (Azido)ynamides: An Efficient Strategy for the Construction of Indoloquinolines.
Organic letters, 2014, 16, 3138-3141
1516462 CIFC29 H22 N2 O2 SP b c a19.6725; 18.2791; 12.5149
90; 90; 90
4500.3Tokimizu, Yusuke; Oishi, Shinya; Fujii, Nobutaka; Ohno, Hiroaki
Gold-Catalyzed Cascade Cyclization of (Azido)ynamides: An Efficient Strategy for the Construction of Indoloquinolines.
Organic letters, 2014, 16, 3138-3141
1516463 CIFC140 H116 N12 O15 S20 Zn3P -110.7122; 16.4862; 19.402
101.781; 102.522; 97.189
3222.6Bill, Nathan L.; Ishida, Masatoshi; Kawashima, Yuki; Ohkubo, Kei; Sung, Young Mo; Lynch, Vincent M.; Lim, Jong Min; Kim, Dongho; Sessler, Jonathan L.; Fukuzumi, Shunichi
Long-lived charge-separated states produced in supramolecular complexes between anionic and cationic porphyrins
Chemical Science, 2014, 5, 3888
1516464 CIFC26 H30 Cl N2 O4C 1 2 121.651; 8.9952; 13.072
90; 92.662; 90
2543.1Xu, Jianfeng; Mou, Chengli; Zhu, Tingshun; Song, Bao-An; Chi, Yonggui Robin
N-heterocyclic carbene-catalyzed chemoselective cross-aza-benzoin reaction of enals with isatin-derived ketimines: access to chiral quaternary aminooxindoles.
Organic letters, 2014, 16, 3272-3275
1516465 CIFC65 H71 Cl4 N34 O29 ZnP -117.6178; 18.0031; 18.3649
88.054; 64.192; 73.825
5010.6Xiao, Xin; Sun, Nana; Qi, Dongdong; Jiang, Jianzhuang
Unprecedented Cucurbituril-Based Ternary Host-Guest Supramolecular Polymers Mediated through Included Alkyl Chains
Polymer Chemistry, 2014, 5, 5211-5217
1516466 CIFC134 H142 Cl20 N68 O89 Zn4P 1 2/n 123.2417; 17.5255; 30.5983
90; 108.234; 90
11837.5Xiao, Xin; Sun, Nana; Qi, Dongdong; Jiang, Jianzhuang
Unprecedented Cucurbituril-Based Ternary Host-Guest Supramolecular Polymers Mediated through Included Alkyl Chains
Polymer Chemistry, 2014, 5, 5211-5217
1516467 CIFC17 H12 N6 O3P 1 21/c 114.3995; 12.2923; 17.5766
90; 92.766; 90
3107.49Graham, Duncan; Fruk, Ljiljana; Ewen Smith, W.
Detection of DNA probes using Diels Alder cycloaddition and SERRS
The Analyst, 2003, 128, 692
1516468 CIFC36 H44 K N4 O11.5P -111.7592; 12.747; 13.3933
98.948; 100.21; 97.418
1926.2Li, Chengjie; Ulrich, Markus; Liu, Xiujun; Wurst, Klaus; Müller, Thomas; Kräutler, Bernhard
Blue transition metal complexes of a natural bilin-type chlorophyll catabolite
Chemical Science, 2014, 5, 3388
1516469 CIFC22 H34 N4 O4 Pd SP 21 21 219.374; 14.5468; 19.7294
90; 90; 90
2690.33Poveda, Ana; Alonso, Inés; Fernández-Ibáñez, M. Ángeles
Experimental and computational studies on the mechanism of the Pd-catalyzed C(sp3)‒H γ-arylation of amino acid derivatives assisted by the 2-pyridylsulfonyl group
Chemical Science, 2014, 5, 3873
1516470 CIFC20 H26 O4P 21 21 217.3028; 13.9746; 16.4665
90; 90; 90
1680.5Chen, Shenxi; Zhang, Yang; Niu, Shubin; Liu, Xingzhong; Che, Yongsheng
Cytotoxic Cleistanthane and Cassane Diterpenoids from the Entomogenous Fungus Paraconiothyrium hawaiiense.
Journal of natural products, 2014, 77, 1513-1518
1516471 CIFC20 H30 O5P 21 21 217.2054; 8.0628; 31.8423
90; 90; 90
1849.9Chen, Shenxi; Zhang, Yang; Niu, Shubin; Liu, Xingzhong; Che, Yongsheng
Cytotoxic Cleistanthane and Cassane Diterpenoids from the Entomogenous Fungus Paraconiothyrium hawaiiense.
Journal of natural products, 2014, 77, 1513-1518
1516472 CIFC20 H14 OP 1 21/c 15.584; 12.995; 19.423
90; 93.534; 90
1406.7Ryerson, Joseph L.; Schrauben, Joel N.; Ferguson, Andrew J.; Sahoo, Subash Chandra; Naumov, Panče; Havlas, Zdenĕk; Michl, Josef; Nozik, Arthur J.; Johnson, Justin C.
Two Thin Film Polymorphs of the Singlet Fission Compound 1,3-Diphenylisobenzofuran
The Journal of Physical Chemistry C, 2014, 118, 12121
1516473 CIFC20 H14 OP 1 2/c 112.998; 5.59; 20.271
90; 106.215; 90
1414.3Ryerson, Joseph L.; Schrauben, Joel N.; Ferguson, Andrew J.; Sahoo, Subash Chandra; Naumov, Panče; Havlas, Zdenĕk; Michl, Josef; Nozik, Arthur J.; Johnson, Justin C.
Two Thin Film Polymorphs of the Singlet Fission Compound 1,3-Diphenylisobenzofuran
The Journal of Physical Chemistry C, 2014, 118, 12121
1516474 CIFC24 H43 N2 O Si YP 1 21/c 114.4575; 16.6903; 10.454
90; 95.093; 90
2512.6Liu, Siqian; Du, Gaixia; He, Jianyun; Long, Yingyun; Zhang, Shaowen; Li, Xiaofang
Cationic Tropidinyl Scandium Catalyst: A Perfectly Acceptable Substitute for Cationic Half-Sandwich Scandium Catalysts incis-1,4-Polymerization of Isoprene and Copolymerization with Norbornene
Macromolecules, 2014, 47, 3567
1516475 CIFC10 H17.5 N0.5 O0.5 Sc0.5 SiP n m a12.865; 16.159; 11.71
90; 90; 90
2434.3Liu, Siqian; Du, Gaixia; He, Jianyun; Long, Yingyun; Zhang, Shaowen; Li, Xiaofang
Cationic Tropidinyl Scandium Catalyst: A Perfectly Acceptable Substitute for Cationic Half-Sandwich Scandium Catalysts incis-1,4-Polymerization of Isoprene and Copolymerization with Norbornene
Macromolecules, 2014, 47, 3567
1516476 CIFC32 H62 Lu2 N2 O2 Si2P n a 2119.256; 10.164; 18.218
90; 90; 90
3565.6Liu, Siqian; Du, Gaixia; He, Jianyun; Long, Yingyun; Zhang, Shaowen; Li, Xiaofang
Cationic Tropidinyl Scandium Catalyst: A Perfectly Acceptable Substitute for Cationic Half-Sandwich Scandium Catalysts incis-1,4-Polymerization of Isoprene and Copolymerization with Norbornene
Macromolecules, 2014, 47, 3567
1516477 CIFC18 H18 Br N O4 SP 1 21/c 112.50619; 11.55718; 12.58675
90; 97.3759; 90
1804.19Medina, Florian; Besnard, Céline; Lacour, Jérôme
One-Step Synthesis of Nitrogen-Containing Medium-Sized Rings via α-Imino Diazo Intermediates.
Organic letters, 2014, 16, 3232-3235
1516478 CIFC17 H16 Br N O4 SP 1 21/a 112.4111; 11.2306; 12.7572
90; 98.363; 90
1759.24Medina, Florian; Besnard, Céline; Lacour, Jérôme
One-Step Synthesis of Nitrogen-Containing Medium-Sized Rings via α-Imino Diazo Intermediates.
Organic letters, 2014, 16, 3232-3235
1516479 CIFC9 H8 O4P 1 21/c 111.233; 6.544; 11.231
90; 95.89; 90
821.2Harrison, Andrew; Ibberson, Richard; Robb, Graeme; Whittaker, Gavin; Wilson, Chick; Youngson, Douglas
In situ neutron diffraction studies of single crystals and powders during microwave irradiation
Faraday Discussions, 2003, 122, 363-379
1516480 CIFC9 H8 O4P 1 21/c 111.233; 6.544; 11.231
90; 95.89; 90
821.2Harrison, Andrew; Ibberson, Richard; Robb, Graeme; Whittaker, Gavin; Wilson, Chick; Youngson, Douglas
In situ neutron diffraction studies of single crystals and powders during microwave irradiation
Faraday Discussions, 2003, 122, 363-379
1516481 CIFC9 H8 O4P 1 21/c 111.233; 6.544; 11.231
90; 95.89; 90
821.2Harrison, Andrew; Ibberson, Richard; Robb, Graeme; Whittaker, Gavin; Wilson, Chick; Youngson, Douglas
In situ neutron diffraction studies of single crystals and powders during microwave irradiation
Faraday Discussions, 2003, 122, 363-379
1516482 CIFC9 H8 O4P 1 21/c 111.233; 6.544; 11.231
90; 95.89; 90
821.2Harrison, Andrew; Ibberson, Richard; Robb, Graeme; Whittaker, Gavin; Wilson, Chick; Youngson, Douglas
In situ neutron diffraction studies of single crystals and powders during microwave irradiation
Faraday Discussions, 2003, 122, 363-379
1516483 CIFC28 H19 N O2P 1 21/c 111.1602; 8.3306; 21.5276
90; 100.005; 90
1971.01Reid, Gavin D.; Whittaker, Douglas J.; Roth, Wolfgang; Whitaker, Benjamin J.; Williamson, Matthew J. I.; Beddard, Godfrey S.
Excited State Dynamics and Rapid Internal Conversion in a Stable Dipole Molecule
Photochemical & Photobiological Sciences, 2003, 2, 585-590
1516484 CIFC34 H46 N7 O8P -111.154; 12.559; 14.72
73.76; 74.41; 82.1
1902.6Darcos, Vincent; Griffith, Kirsten; Sallenave, Xavier; Desvergne, Jean-Pierre; Guyard-Duhayon, Carine; Hasenknopf, Bernold; Bassani, Dario M.
Supramolecular control of [2 + 2] photodimerization via hydrogen bonding
Photochemical & Photobiological Sciences, 2003, 2, 1152-1161
1516485 CIFC20 H15 N O SP 1 21/c 130.3283; 12.9666; 7.8988
90; 96.205; 90
3088.04Pérez-Prieto, Julia; Galian, Raquel E.; Morant-Miñana, Maria C.; Miranda, Miguel A.
Steady-state and time-resolved studies on the formation of skatolyl radicals photosensitized by 2-benzoylthiophene
Photochemical & Photobiological Sciences, 2003, 2, 1200-1204
1516486 CIFC56 H30 F22 S4P -112.139; 13.875; 15.819
77.15; 83.416; 75.489
2509.9Morimoto, Masakazu; Kobatake, Seiya; Irie, Masahiro
Photochromism of diarylethenes in nanolayers of a single crystal
Photochemical & Photobiological Sciences, 2003, 2, 1088-1094
1516487 CIFC56 H30 F22 S4P -111.737; 13.717; 15.352
76.844; 83.197; 75.445
2325Morimoto, Masakazu; Kobatake, Seiya; Irie, Masahiro
Photochromism of diarylethenes in nanolayers of a single crystal
Photochemical & Photobiological Sciences, 2003, 2, 1088-1094
1516488 CIFC28 H28 O5P 1 21/n 117.2708; 5.714; 23.476
90; 98.234; 90
2292.9Charette, André B.; Chong, Kenneth C. W.; Fournier, Jean-François; Patrick, Brian; Scheffer, John R.
Asymmetric synthesis in a Norrish type II cleavage reaction induced by crystal chirality
Photochemical & Photobiological Sciences, 2003, 2, 1052-1055
1516489 CIFC27 H23 N OP 1 21/c 110.872; 23.494; 24.378
90; 93.585; 90
6215Yang, Jye-Shane; Wang, Chin-Min; Hwang, Chung-Yu; Liau, Kang-Ling; Chiou, Shih-Yi
Origin of the N-methyl and N-phenyl substituent effects on the fluorescence vibronic structures of trans-4-aminostilbene and its derivatives in hexane
Photochemical & Photobiological Sciences, 2003, 2, 1225-1231
1516490 CIFC19 H14 O2P b c a26.9628; 15.3036; 6.9176
90; 90; 90
2854.39Sundaryono, Agus; Nourmamode, Aziz; Gardrat, Christian; Grelier, Stéphane; Bravic, Georges; Chasseau, Daniel; Castellan, Alain
Studies on the photochemistry of 1,7-diphenyl-1,6-heptadiene-3,5-dione, a non-phenolic curcuminoid model
Photochemical & Photobiological Sciences, 2003, 2, 914-920
1516491 CIFC6 H4 Cd N6 O2 PtF m -3 m10.166; 10.166; 10.166
90; 90; 90
1050.6Ware, Mike
Prussian Blue: Artists' Pigment and Chemists' Sponge
Journal of Chemical Education, 2008, 85, 612
1516492 CIFC6 Cd N6 PtF m -3 m10.166; 10.166; 10.166
90; 90; 90
1050.6Ware, Mike
Prussian Blue: Artists' Pigment and Chemists' Sponge
Journal of Chemical Education, 2008, 85, 612
1516493 CIFC20 H23 N O6P 21 21 2111.2062; 12.595; 12.8803
90; 90; 90
1818Yan, Meng-Hong; Cheng, Pi; Jiang, Zhi-Yong; Ma, Yun-Bao; Zhang, Xue-Mei; Zhang, Feng-Xue; Yang, Liu-Meng; Zheng, Yong-Tang; Chen, Ji-Jun
Periglaucines A-D, anti-HBV and -HIV-1 alkaloids from Pericampylus glaucus.
Journal of natural products, 2008, 71, 760-763
1516498 CIFC34 H28 N2 O4P b c a16.1351; 15.7795; 21.2316
90; 90; 90
5405.6Frischmann, Peter D.; Jiang, Jian; Hui, Joseph K.-H.; Grzybowski, Joseph J.; MacLachlan, Mark J.
Reversible-irreversible approach to Schiff base macrocycles: access to isomeric macrocycles with multiple salphen pockets.
Organic letters, 2008, 10, 1255-1258
1516499 CIFC38 H36 P2 S2P 1 21/c 110.201; 19.08; 16.886
90; 98.7827; 90
3248Furukawa, Shunsuke; Haga, Shunsuke; Kobayashi, Junji; Kawashima, Takayuki
Synthesis of π-Extended Dibenzophospholes by Intramolecular Radical Cyclization and Their Properties.
Organic letters, 2014, 16, 3228-3231
1516500 CIFC38 H36 P2 S2P -19.151; 12.814; 15.408
109.378; 91.446; 107.726
1607.4Furukawa, Shunsuke; Haga, Shunsuke; Kobayashi, Junji; Kawashima, Takayuki
Synthesis of π-Extended Dibenzophospholes by Intramolecular Radical Cyclization and Their Properties.
Organic letters, 2014, 16, 3228-3231
1516501 CIFC23 H23 N O6P 21 21 217.4232; 16.138; 16.7378
90; 90; 90
2005.11Xiao, You-Cai; Yue, Cai-Zhen; Chen, Peng-Qiao; Chen, Ying-Chun
Asymmetric Dearomatic Diels-Alder Reactions of Diverse Heteroarenes via π-System Activation.
Organic letters, 2014, 16, 3208-3211
1516502 CIFC12.5 H17.5 Cl2 N2.5 O3 Ru S3P 1 n 111.7724; 13.4968; 12.2285
90; 110.968; 90
1814.32Chan, Siu-Chung; England, Jason; Wieghardt, Karl; Wong, Chun-Yuen
Trapping of the putative 1,2-dinitrosoarene intermediate of benzofuroxan tautomerization by coordination at ruthenium and exploration of its redox non-innocence
Chemical Science, 2014, 5, 3883
1516503 CIFC13 H18 Cl2 N2 O7 Ru S3P 1 21/c 116.4668; 19.6645; 12.6551
90; 106.281; 90
3933.53Chan, Siu-Chung; England, Jason; Wieghardt, Karl; Wong, Chun-Yuen
Trapping of the putative 1,2-dinitrosoarene intermediate of benzofuroxan tautomerization by coordination at ruthenium and exploration of its redox non-innocence
Chemical Science, 2014, 5, 3883
1516504 CIFC27 H22 F12 N6 O3 P2 RuP 1 21/c 114.059; 14.2401; 15.4559
90; 91.983; 90
3092.44Chan, Siu-Chung; England, Jason; Wieghardt, Karl; Wong, Chun-Yuen
Trapping of the putative 1,2-dinitrosoarene intermediate of benzofuroxan tautomerization by coordination at ruthenium and exploration of its redox non-innocence
Chemical Science, 2014, 5, 3883
1516505 CIFC27 H22 Cl2 F6 N6 O2 P RuP 1 21/c 113.5677; 14.3521; 15.4809
90; 95.869; 90
2998.7Chan, Siu-Chung; England, Jason; Wieghardt, Karl; Wong, Chun-Yuen
Trapping of the putative 1,2-dinitrosoarene intermediate of benzofuroxan tautomerization by coordination at ruthenium and exploration of its redox non-innocence
Chemical Science, 2014, 5, 3883
1516506 CIFC28 H24 Cl2 F6 N6 O3 P RuP b c n14.1173; 15.5837; 28.1669
90; 90; 90
6196.71Chan, Siu-Chung; England, Jason; Wieghardt, Karl; Wong, Chun-Yuen
Trapping of the putative 1,2-dinitrosoarene intermediate of benzofuroxan tautomerization by coordination at ruthenium and exploration of its redox non-innocence
Chemical Science, 2014, 5, 3883
1516507 CIFC6 H10 Co La N6 O5P 63/m7.4597; 7.4597; 14.293
90; 90; 120
688.8Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J.
Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5)
Chemical Science, 2014, 5, 3409
1516508 CIFC6 H8 Fe K La N6 O4P 63/m7.3829; 7.3829; 13.871
90; 90; 120
654.78Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J.
Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5)
Chemical Science, 2014, 5, 3409
1516509 CIFC6 Fe K La N6P -3 1 c7.1852; 7.1852; 12.238
90; 90; 120
547.2Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J.
Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5)
Chemical Science, 2014, 5, 3409
1516510 CIFC6 H9 Co N6 O4.5 PrC m c m7.431; 12.815; 14.298
90; 90; 90
1362Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J.
Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5)
Chemical Science, 2014, 5, 3409
1516511 CIFC6 H9 Fe N6 O4.5 PrC m c m7.523; 13.117; 14.476
90; 90; 90
1428Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J.
Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5)
Chemical Science, 2014, 5, 3409
1516512 CIFC6 H8 Co N6 O4 SmC m c m7.375; 12.742; 13.653
90; 90; 90
1283Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J.
Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5)
Chemical Science, 2014, 5, 3409
1516513 CIFC6 H8 Co Eu N6 O4C m c m7.3394; 12.75; 13.617
90; 90; 90
1274.2Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J.
Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5)
Chemical Science, 2014, 5, 3409
1516514 CIFC6 H6 Fe Lu N6 Na O3C m c m7.242; 12.578; 13.361
90; 90; 90
1217.1Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J.
Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5)
Chemical Science, 2014, 5, 3409
1516515 CIFC6 H8 Fe La Li N6 O4P 63/m7.2338; 7.2338; 14.2923
90; 90; 120
647.69Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J.
Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5)
Chemical Science, 2014, 5, 3409
1516516 CIFC6 H6 Fe Li Lu N6 O3C m c m7.2309; 12.5358; 13.2519
90; 90; 90
1201.2Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J.
Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5)
Chemical Science, 2014, 5, 3409
1516517 CIFC15 H15 N O2P 1 21/n 110.2481; 10.1664; 12.1731
90; 93.195; 90
1266.3Zhang, Zhi-Jing; Quan, Xue-Jing; Ren, Zhi-Hui; Wang, Yao-Yu; Guan, Zheng-Hui
A Facile BPO-Mediated ortho-Hydroxylation and Benzoylation of N-Alkyl Anilines for Synthesis of 2-Benzamidophenols.
Organic letters, 2014, 16, 3292-3295
1516518 CIFC14 H13 N O2P 1 21/c 18.226; 11.711; 13.239
90; 106.88; 90
1220.4Zhang, Zhi-Jing; Quan, Xue-Jing; Ren, Zhi-Hui; Wang, Yao-Yu; Guan, Zheng-Hui
A Facile BPO-Mediated ortho-Hydroxylation and Benzoylation of N-Alkyl Anilines for Synthesis of 2-Benzamidophenols.
Organic letters, 2014, 16, 3292-3295
1516519 CIFC16 H16 N2 O5P 1 c 110.838; 11.225; 13.268
90; 107.879; 90
1536.2Manin, Alex N.; Voronin, Alexander P.; Manin, Nikolay G.; Vener, Mikhail V.; Shishkina, Anastasia V.; Lermontov, Anatoly S.; Perlovich, German L.
Salicylamide cocrystals: screening, crystal structure, sublimation thermodynamics, dissolution, and solid-state DFT calculations.
The journal of physical chemistry. B, 2014, 118, 6803-6814
1516520 CIFC27 H26 Cr F3 N4 O5P 1 21/c 112.2189; 13.6109; 15.9826
90; 102.501; 90
2595.1Elmas, Sait; Subhani, Muhammad A.; Harrer, Marcus; Leitner, Walter; Sundermeyer, Jörg; Müller, Thomas E.
Highly active Cr(iii) catalysts for the reaction of CO2 with epoxides
Catalysis Science & Technology, 2014, 4, 1652
1516521 CIFC28 H33 Cl Cr N5 O4P 1 21/n 19.8802; 14.1274; 19.4439
90; 94.197; 90
2706.73Elmas, Sait; Subhani, Muhammad A.; Harrer, Marcus; Leitner, Walter; Sundermeyer, Jörg; Müller, Thomas E.
Highly active Cr(iii) catalysts for the reaction of CO2 with epoxides
Catalysis Science & Technology, 2014, 4, 1652
1516522 CIFC26 H31 N O5P 21 21 217.495; 10.4454; 35.197
90; 90; 90
2755.5Letort, Aurélien; Aouzal, Rémi; Ma, Cong; Long, De-Liang; Prunet, Joëlle
Highly efficient synthesis of the tricyclic core of taxol by cascade metathesis.
Organic letters, 2014, 16, 3300-3303
1516523 CIFC15 H18 N2 O2P 1 21 16.546; 12.058; 8.846
90; 97.94; 90
691.5Kise, Naoki; Hamada, Yusuke; Sakurai, Toshihiko
Electroreductive Coupling of Optically Active α,β-Unsaturated Carbonyl Compounds with Diaryl Ketones: Asymmetric Synthesis of 4,5,5-Trisubstituted γ-Butyrolactones.
Organic letters, 2014, 16, 3348-3351

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