Crystallography Open Database

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4510273 CIFC22 H18 Cu N4 O4I 1 2/a 114.5663; 13.4855; 24.6581
90; 94.734; 90
4827.2Parshamoni, Srinivasulu; Sanda, Suresh; Jena, Himanshu Sekhar; Tomar, Kapil; Konar, Sanjit
Exploration of Structural Topologies in Metal‒Organic Frameworks Based on 3-(4-Carboxyphenyl)propionic Acid, Their Synthesis, Sorption, and Luminescent Property Studies
Crystal Growth & Design, 2014, 14, 2022
4510274 CIFC44 H36 Cd2 N8 O8P 1 21/c 123.6532; 16.1209; 13.6472
90; 97.159; 90
5163.3Parshamoni, Srinivasulu; Sanda, Suresh; Jena, Himanshu Sekhar; Tomar, Kapil; Konar, Sanjit
Exploration of Structural Topologies in Metal‒Organic Frameworks Based on 3-(4-Carboxyphenyl)propionic Acid, Their Synthesis, Sorption, and Luminescent Property Studies
Crystal Growth & Design, 2014, 14, 2022
4510275 CIFC20 H20 Cu N8 O4 P2I 41/a c d :219.418; 19.418; 25.392
90; 90; 90
9574Gupta, Arvind K.; Srivastava, Anant Kumar; Mahawar, Indra Kumar; Boomishankar, Ramamoorthy
Discrete and Polymeric Cu(II) Complexes Derived from in Situ Generated Pyridyl-Functionalized Bis(amido)phosphate Ligands, [PO2(NHPy)2]−
Crystal Growth & Design, 2014, 14, 1701
4510276 CIFC26 H42 Cu N10 O10 P2C c c m13.158; 14.942; 16.667
90; 90; 90
3277Gupta, Arvind K.; Srivastava, Anant Kumar; Mahawar, Indra Kumar; Boomishankar, Ramamoorthy
Discrete and Polymeric Cu(II) Complexes Derived from in Situ Generated Pyridyl-Functionalized Bis(amido)phosphate Ligands, [PO2(NHPy)2]−
Crystal Growth & Design, 2014, 14, 1701
4510277 CIFC20 H24 Cu N8 O6 P2C c c m13.158; 14.942; 16.667
90; 90; 90
3277Gupta, Arvind K.; Srivastava, Anant Kumar; Mahawar, Indra Kumar; Boomishankar, Ramamoorthy
Discrete and Polymeric Cu(II) Complexes Derived from in Situ Generated Pyridyl-Functionalized Bis(amido)phosphate Ligands, [PO2(NHPy)2]−
Crystal Growth & Design, 2014, 14, 1701
4510278 CIFC20 H22 Cu N8 O6 P2C c c m13.4495; 15.0521; 16.6729
90; 90; 90
3375.3Gupta, Arvind K.; Srivastava, Anant Kumar; Mahawar, Indra Kumar; Boomishankar, Ramamoorthy
Discrete and Polymeric Cu(II) Complexes Derived from in Situ Generated Pyridyl-Functionalized Bis(amido)phosphate Ligands, [PO2(NHPy)2]−
Crystal Growth & Design, 2014, 14, 1701
4510279 CIFC26 H34 Cu N10 O6 P2P 1 21/n 111.08; 10.0088; 14.0334
90; 90.584; 90
1556.19Gupta, Arvind K.; Srivastava, Anant Kumar; Mahawar, Indra Kumar; Boomishankar, Ramamoorthy
Discrete and Polymeric Cu(II) Complexes Derived from in Situ Generated Pyridyl-Functionalized Bis(amido)phosphate Ligands, [PO2(NHPy)2]−
Crystal Growth & Design, 2014, 14, 1701
4510280 CIFC53 H65 Cu2 N21 O11 P4P 1 21/c 111.6307; 19.702; 15.3466
90; 110.414; 90
3295.8Gupta, Arvind K.; Srivastava, Anant Kumar; Mahawar, Indra Kumar; Boomishankar, Ramamoorthy
Discrete and Polymeric Cu(II) Complexes Derived from in Situ Generated Pyridyl-Functionalized Bis(amido)phosphate Ligands, [PO2(NHPy)2]−
Crystal Growth & Design, 2014, 14, 1701
4510282 CIFC22 H24 N2 O8P -17.3792; 9.4077; 14.9887
79.44; 81.526; 88.573
1011.74Grecu, Tudor; Adams, Harry; Hunter, Christopher A.; McCabe, James F.; Portell, Anna; Prohens, Rafel
Virtual Screening Identifies New Cocrystals of Nalidixic Acid
Crystal Growth & Design, 2014, 14, 1749
4510283 CIFC22 H26 N2 O5P -16.9991; 12.106; 13.199
96.07; 103.76; 106.11
1025.8Grecu, Tudor; Adams, Harry; Hunter, Christopher A.; McCabe, James F.; Portell, Anna; Prohens, Rafel
Virtual Screening Identifies New Cocrystals of Nalidixic Acid
Crystal Growth & Design, 2014, 14, 1749
4510284 CIFC28 H26 N4 O3P -113.2492; 10.8238; 8.37998
96.0718; 93.5031; 91.5041
1192.12Grecu, Tudor; Adams, Harry; Hunter, Christopher A.; McCabe, James F.; Portell, Anna; Prohens, Rafel
Virtual Screening Identifies New Cocrystals of Nalidixic Acid
Crystal Growth & Design, 2014, 14, 1749
4510285 CIFC24 H22 N2 O4P 1 21/c 119.3678; 13.85573; 7.72653
90; 95.03; 90
2065.47Grecu, Tudor; Adams, Harry; Hunter, Christopher A.; McCabe, James F.; Portell, Anna; Prohens, Rafel
Virtual Screening Identifies New Cocrystals of Nalidixic Acid
Crystal Growth & Design, 2014, 14, 1749
4510286 CIFC30 H36 Fe N6 S2P -110.1658; 17.0109; 19.4946
85.379; 84.001; 73.599
3211.7Wöhlert, Susanne; Runčevski, Tomče; Dinnebier, Robert E.; Ebbinghaus, Stefan G.; Näther, Christian
Synthesis, Structures, Polymorphism, and Magnetic Properties of Transition Metal Thiocyanato Coordination Compounds
Crystal Growth & Design, 2014, 14, 1902
4510287 CIFC30 H36 Mn N6 S2P 1 21/c 19.8148; 16.9806; 20.0807
90; 99.849; 90
3297.4Wöhlert, Susanne; Runčevski, Tomče; Dinnebier, Robert E.; Ebbinghaus, Stefan G.; Näther, Christian
Synthesis, Structures, Polymorphism, and Magnetic Properties of Transition Metal Thiocyanato Coordination Compounds
Crystal Growth & Design, 2014, 14, 1902
4510288 CIFC30 H36 Fe N6 S2P -110.3881; 16.3106; 20.1423
91.552; 90.799; 102.835
3325.6Wöhlert, Susanne; Runčevski, Tomče; Dinnebier, Robert E.; Ebbinghaus, Stefan G.; Näther, Christian
Synthesis, Structures, Polymorphism, and Magnetic Properties of Transition Metal Thiocyanato Coordination Compounds
Crystal Growth & Design, 2014, 14, 1902
4510289 CIFC16 H18 N4 Ni S2P -18.9684; 10.677; 10.956
67.46; 67.36; 83.94
893.21Wöhlert, Susanne; Runčevski, Tomče; Dinnebier, Robert E.; Ebbinghaus, Stefan G.; Näther, Christian
Synthesis, Structures, Polymorphism, and Magnetic Properties of Transition Metal Thiocyanato Coordination Compounds
Crystal Growth & Design, 2014, 14, 1902
4510290 CIFC16 H18 N4 Ni S2C 1 c 111.1707; 39.5124; 9.133
90; 115.2; 90
3647.5Wöhlert, Susanne; Runčevski, Tomče; Dinnebier, Robert E.; Ebbinghaus, Stefan G.; Näther, Christian
Synthesis, Structures, Polymorphism, and Magnetic Properties of Transition Metal Thiocyanato Coordination Compounds
Crystal Growth & Design, 2014, 14, 1902
4510291 CIFC16 H18 Mn N4 S2P 1 21/c 15.7737; 18.3907; 8.5647
90; 96.165; 90
904.16Wöhlert, Susanne; Runčevski, Tomče; Dinnebier, Robert E.; Ebbinghaus, Stefan G.; Näther, Christian
Synthesis, Structures, Polymorphism, and Magnetic Properties of Transition Metal Thiocyanato Coordination Compounds
Crystal Growth & Design, 2014, 14, 1902
4510292 CIFC30 H36 Mn N6 S2P -111.8301; 16.4075; 18.6847
72.304; 75.684; 77.015
3303.6Wöhlert, Susanne; Runčevski, Tomče; Dinnebier, Robert E.; Ebbinghaus, Stefan G.; Näther, Christian
Synthesis, Structures, Polymorphism, and Magnetic Properties of Transition Metal Thiocyanato Coordination Compounds
Crystal Growth & Design, 2014, 14, 1902
4510293 CIFC16 H22 Mn N4 O2 S2P 1 21/c 111.0253; 12.8112; 7.6416
90; 107.476; 90
1029.54Wöhlert, Susanne; Runčevski, Tomče; Dinnebier, Robert E.; Ebbinghaus, Stefan G.; Näther, Christian
Synthesis, Structures, Polymorphism, and Magnetic Properties of Transition Metal Thiocyanato Coordination Compounds
Crystal Growth & Design, 2014, 14, 1902
4510294 CIFC17 H33 Br N2P -111.009; 12.165; 23.177
94.727; 95.591; 110.903
2862.9Yang, Mei; Mallick, Bert; Mudring, Anja-Verena
A Systematic Study on the Mesomorphic Behavior of Asymmetrical 1-Alkyl-3-dodecylimidazolium Bromides
Crystal Growth & Design, 2014, 14, 1561
4510295 CIFC26 H30 S2 Si2C 1 c 112.246; 12.25; 34.687
90; 90.55; 90
5203.3Postnikov, Valery A.; Odarchenko, Yaroslav I.; Iovlev, Alexander V.; Bruevich, Vladimir V.; Pereverzev, Alexander Yu.; Kudryashova, Ludmila G.; Sobornov, Vladimir V.; Vidal, Loïc; Chernyshov, Dmitry; Luponosov, Yuriy N.; Borshchev, Oleg V.; Surin, Nikolay M.; Ponomarenko, Sergei A.; Ivanov, Dimitri A.; Paraschuk, Dmitry Yu.
Molecularly Smooth Single-Crystalline Films of Thiophene–Phenylene Co-Oligomers Grown at the Gas–Liquid Interface
Crystal Growth & Design, 2014, 14, 1726
4510296 CIFC20 H12 F2 S2P 1 21/n 15.7908; 7.2544; 35.8193
90; 94.256; 90
1500.58Postnikov, Valery A.; Odarchenko, Yaroslav I.; Iovlev, Alexander V.; Bruevich, Vladimir V.; Pereverzev, Alexander Yu.; Kudryashova, Ludmila G.; Sobornov, Vladimir V.; Vidal, Loïc; Chernyshov, Dmitry; Luponosov, Yuriy N.; Borshchev, Oleg V.; Surin, Nikolay M.; Ponomarenko, Sergei A.; Ivanov, Dimitri A.; Paraschuk, Dmitry Yu.
Molecularly Smooth Single-Crystalline Films of Thiophene–Phenylene Co-Oligomers Grown at the Gas–Liquid Interface
Crystal Growth & Design, 2014, 14, 1726
4510297 CIFC60 H84 Ag3 N15 O24C 1 2/c 132.4383; 16.1532; 14.8332
90; 107.194; 90
7425Kim, Euni; Lee, Haeri; Noh, Tae Hwan; Jung, Ok-Sang
Suprachannels via a Molecular Array of 2D Networks: Solvent Effects, Anion Exchange, and Physicochemical Properties of Silver(I) Complexes BearingN,N′,N″-Tris(2-pyridinylethyl)-1,3,5-benzenetricarboxamide
Crystal Growth & Design, 2014, 14, 1888
4510298 CIFC64 H88 Ag3 N15 O25C 1 2/c 133.154; 16.0516; 14.9568
90; 108.308; 90
7556.73Kim, Euni; Lee, Haeri; Noh, Tae Hwan; Jung, Ok-Sang
Suprachannels via a Molecular Array of 2D Networks: Solvent Effects, Anion Exchange, and Physicochemical Properties of Silver(I) Complexes BearingN,N′,N″-Tris(2-pyridinylethyl)-1,3,5-benzenetricarboxamide
Crystal Growth & Design, 2014, 14, 1888
4510299 CIFC62 H72 Ag3 N15 O19P 1 21/c 114.1583; 27.6117; 9.6431
90; 94.526; 90
3758.07Kim, Euni; Lee, Haeri; Noh, Tae Hwan; Jung, Ok-Sang
Suprachannels via a Molecular Array of 2D Networks: Solvent Effects, Anion Exchange, and Physicochemical Properties of Silver(I) Complexes BearingN,N′,N″-Tris(2-pyridinylethyl)-1,3,5-benzenetricarboxamide
Crystal Growth & Design, 2014, 14, 1888
4510300 CIFB6 Br K1.7 Na1.3 O10P n m a12.867; 9.93; 8.001
90; 90; 90
1022Han, Shujuan; Wang, Ying; Pan, Shilie; Dong, Xiaoyu; Wu, Hongping; Han, Jian; Yang, Yun; Yu, Hongwei; Bai, Chunyan
Noncentrosymmetric versus Centrosymmetric: Influence of the Na+Substitution on Structural Transition and Second-Harmonic Generation Property
Crystal Growth & Design, 2014, 14, 1794
4510301 CIFB6 Br K0.8 Na2.2 O10P n m a12.818; 10.041; 7.5413
90; 90; 90
970.6Han, Shujuan; Wang, Ying; Pan, Shilie; Dong, Xiaoyu; Wu, Hongping; Han, Jian; Yang, Yun; Yu, Hongwei; Bai, Chunyan
Noncentrosymmetric versus Centrosymmetric: Influence of the Na+Substitution on Structural Transition and Second-Harmonic Generation Property
Crystal Growth & Design, 2014, 14, 1794
4510302 CIFB6 Br K2.87 Na0.13 O10R 3 m :H10.071; 10.071; 8.824
90; 90; 120
775.1Han, Shujuan; Wang, Ying; Pan, Shilie; Dong, Xiaoyu; Wu, Hongping; Han, Jian; Yang, Yun; Yu, Hongwei; Bai, Chunyan
Noncentrosymmetric versus Centrosymmetric: Influence of the Na+Substitution on Structural Transition and Second-Harmonic Generation Property
Crystal Growth & Design, 2014, 14, 1794
4510303 CIFB6 Br K2.33 Na0.67 O10R 3 m :H10.05; 10.05; 8.816
90; 90; 120
771.1Han, Shujuan; Wang, Ying; Pan, Shilie; Dong, Xiaoyu; Wu, Hongping; Han, Jian; Yang, Yun; Yu, Hongwei; Bai, Chunyan
Noncentrosymmetric versus Centrosymmetric: Influence of the Na+Substitution on Structural Transition and Second-Harmonic Generation Property
Crystal Growth & Design, 2014, 14, 1794
4510304 CIFC4 H9 N O2P b c a11.2209; 10.0203; 18.7351
90; 90; 90
2106.51Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N‒H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510305 CIFC4 H9 N O2P b c a11.2187; 10.0056; 18.73
90; 90; 90
2102.44Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N‒H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510306 CIFC4 H9 N O2P b c a11.20949; 9.98321; 18.7137
90; 90; 90
2094.19Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N‒H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510307 CIFC4 H9 N O2P b c a11.20324; 9.96483; 18.7053
90; 90; 90
2088.23Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N‒H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510308 CIFC4 H9 N O2P 21/b 1 111.1927; 9.9481; 18.6989
90.406; 90; 90
2082Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N‒H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510309 CIFC4 H9 N O2P 21/b 1 111.1828; 9.9261; 18.6889
90.679; 90; 90
2074.35Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N–H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510310 CIFC4 H9 N O2P 21/b 1 111.1763; 9.915; 18.6822
90.912; 90; 90
2069.97Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N‒H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510311 CIFC4 H9 N O2P 21/b 1 111.1668; 9.8988; 18.6714
91.313; 90; 90
2063.36Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N–H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510312 CIFC4 H9 N O2P 21/b 1 111.1619; 9.887; 18.6616
91.493; 90; 90
2058.75Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N–H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510313 CIFC4 H9 N O2P 1 21/n 15.4525; 19.9258; 9.8027
90; 91.76; 90
1064.52Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N–H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510314 CIFC4 H9 N O2P 1 21/n 15.434; 19.9056; 9.7935
90; 91.884; 90
1058.76Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N–H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510315 CIFC4 H9 N O2P 1 21/n 15.4179; 19.8855; 9.7869
90; 91.958; 90
1053.8Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N–H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510316 CIFC4 H9 N O2P 1 21/n 15.403; 19.8661; 9.7808
90; 92.048; 90
1049.17Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N–H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510317 CIFC4 H9 N O2P 1 21/n 15.3874; 19.8354; 9.7721
90; 92.1; 90
1043.56Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N–H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510318 CIFC4 H9 N O2P 1 21/n 15.3738; 19.8094; 9.7661
90; 92.152; 90
1038.89Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N–H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510319 CIFC4 H9 N O2P 1 21/n 15.3615; 19.7898; 9.7622
90; 92.201; 90
1035.03Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N–H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510320 CIFC4 H9 N O2P 1 21/n 15.3512; 19.7699; 9.7591
90; 92.228; 90
1031.66Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N–H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510321 CIFC4 H9 N O2P 1 21/n 15.3412; 19.7534; 9.7538
90; 92.255; 90
1028.3Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V.
One Hydrogen Bond—Two Ways To Build a Structure. The Role of N–H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine
Crystal Growth & Design, 2014, 14, 1851
4510322 CIFC23 H27 Co N5 O7P 1 21 18.4484; 10.3292; 13.6867
90; 104.576; 90
1155.93Mendiratta, Shruti; Usman, Muhammad; Luo, Tzuoo-Tsair; Chang, Bor-Chen; Lee, Shang-Fan; Lin, Ying-Chih; Lu, Kuang-Lieh
Anion-Controlled Dielectric Behavior of Homochiral Tryptophan-Based Metal‒Organic Frameworks
Crystal Growth & Design, 2014, 14, 1572
4510323 CIFC46 H50 N10 O14 Zn2P 1 21 18.4181; 10.3794; 13.6828
90; 103.697; 90
1161.53Mendiratta, Shruti; Usman, Muhammad; Luo, Tzuoo-Tsair; Chang, Bor-Chen; Lee, Shang-Fan; Lin, Ying-Chih; Lu, Kuang-Lieh
Anion-Controlled Dielectric Behavior of Homochiral Tryptophan-Based Metal‒Organic Frameworks
Crystal Growth & Design, 2014, 14, 1572
4510324 CIFC23 H25 Co N5 O7P 1 21 18.4008; 10.3355; 13.677
90; 103.716; 90
1153.7Mendiratta, Shruti; Usman, Muhammad; Luo, Tzuoo-Tsair; Chang, Bor-Chen; Lee, Shang-Fan; Lin, Ying-Chih; Lu, Kuang-Lieh
Anion-Controlled Dielectric Behavior of Homochiral Tryptophan-Based Metal‒Organic Frameworks
Crystal Growth & Design, 2014, 14, 1572
4510325 CIFC24 H9 N0 O11 Zn2P 1 21/c 112.314; 14.986; 27.116
90; 106.765; 90
4791Zhao, Nian; Sun, Fuxing; He, Hongming; Jia, Jiangtao; Zhu, Guangshan
Solvent-Induced Single Crystal To Single Crystal Transformation and Complete Metal Exchange of a Pyrene-Based Metal‒Organic Framework
Crystal Growth & Design, 2014, 14, 1738
4510326 CIFC26 H15 O11 S Zn2P 1 21/c 111.078; 16.012; 23.804
90; 95.333; 90
4204Zhao, Nian; Sun, Fuxing; He, Hongming; Jia, Jiangtao; Zhu, Guangshan
Solvent-Induced Single Crystal To Single Crystal Transformation and Complete Metal Exchange of a Pyrene-Based Metal‒Organic Framework
Crystal Growth & Design, 2014, 14, 1738
4510327 CIFC24 H0 Cu2 O11P 1 21/c 112.435; 14.584; 27.018
90; 107.87; 90
4663Zhao, Nian; Sun, Fuxing; He, Hongming; Jia, Jiangtao; Zhu, Guangshan
Solvent-Induced Single Crystal To Single Crystal Transformation and Complete Metal Exchange of a Pyrene-Based Metal‒Organic Framework
Crystal Growth & Design, 2014, 14, 1738
4510328 CIFC30 H19 N3 O7.5 Zn2C 1 2/c 123.798; 19.705; 13.445
90; 112.564; 90
5822Xu, Bing; Xie, Juan; Hu, Huai-Ming; Yang, Xiao-Le; Dong, Fa-Xin; Yang, Meng-Lin; Xue, Gang-Lin
Synthesis, Crystal Structure, and Luminescence of Zn/Cd Coordination Polymers with a New Fuctionalized Terpyridyl Carboxylate Ligand
Crystal Growth & Design, 2014, 14, 1629
4510329 CIFC22 H14 Cl N3 O2 ZnP 1 21/n 112.1335; 7.9711; 20.3084
90; 97.443; 90
1947.6Xu, Bing; Xie, Juan; Hu, Huai-Ming; Yang, Xiao-Le; Dong, Fa-Xin; Yang, Meng-Lin; Xue, Gang-Lin
Synthesis, Crystal Structure, and Luminescence of Zn/Cd Coordination Polymers with a New Fuctionalized Terpyridyl Carboxylate Ligand
Crystal Growth & Design, 2014, 14, 1629
4510330 CIFC52 H34 N6 O9 Zn2P 1 2/n 112.5807; 9.3402; 19.104
90; 103.775; 90
2180.3Xu, Bing; Xie, Juan; Hu, Huai-Ming; Yang, Xiao-Le; Dong, Fa-Xin; Yang, Meng-Lin; Xue, Gang-Lin
Synthesis, Crystal Structure, and Luminescence of Zn/Cd Coordination Polymers with a New Fuctionalized Terpyridyl Carboxylate Ligand
Crystal Growth & Design, 2014, 14, 1629
4510331 CIFC52 H32 N6 O8 Zn2P -112.4642; 12.5823; 15.269
104.357; 108.967; 90.771
2182.3Xu, Bing; Xie, Juan; Hu, Huai-Ming; Yang, Xiao-Le; Dong, Fa-Xin; Yang, Meng-Lin; Xue, Gang-Lin
Synthesis, Crystal Structure, and Luminescence of Zn/Cd Coordination Polymers with a New Fuctionalized Terpyridyl Carboxylate Ligand
Crystal Growth & Design, 2014, 14, 1629
4510332 CIFC88 H56 Cd2 N12 O9P -111.605; 12.34; 14.606
99.002; 96.346; 116.734
1805.8Xu, Bing; Xie, Juan; Hu, Huai-Ming; Yang, Xiao-Le; Dong, Fa-Xin; Yang, Meng-Lin; Xue, Gang-Lin
Synthesis, Crystal Structure, and Luminescence of Zn/Cd Coordination Polymers with a New Fuctionalized Terpyridyl Carboxylate Ligand
Crystal Growth & Design, 2014, 14, 1629
4510333 CIFC60 H36 Cd3 N6 O12P 1 21/n 114.896; 9.8043; 17.559
90; 93.155; 90
2560.5Xu, Bing; Xie, Juan; Hu, Huai-Ming; Yang, Xiao-Le; Dong, Fa-Xin; Yang, Meng-Lin; Xue, Gang-Lin
Synthesis, Crystal Structure, and Luminescence of Zn/Cd Coordination Polymers with a New Fuctionalized Terpyridyl Carboxylate Ligand
Crystal Growth & Design, 2014, 14, 1629
4510334 CIFC88 H56 N12 O10 Zn2P -111.5711; 12.1705; 14.5802
98.625; 94.455; 116.501
1792.3Xu, Bing; Xie, Juan; Hu, Huai-Ming; Yang, Xiao-Le; Dong, Fa-Xin; Yang, Meng-Lin; Xue, Gang-Lin
Synthesis, Crystal Structure, and Luminescence of Zn/Cd Coordination Polymers with a New Fuctionalized Terpyridyl Carboxylate Ligand
Crystal Growth & Design, 2014, 14, 1629
4510335 CIFC136 H86 N12 O39 Zn9P -114.198; 14.443; 18.56
67.524; 71.377; 65.82
3147.9Xu, Bing; Xie, Juan; Hu, Huai-Ming; Yang, Xiao-Le; Dong, Fa-Xin; Yang, Meng-Lin; Xue, Gang-Lin
Synthesis, Crystal Structure, and Luminescence of Zn/Cd Coordination Polymers with a New Fuctionalized Terpyridyl Carboxylate Ligand
Crystal Growth & Design, 2014, 14, 1629
4510336 CIFC54 H50 N2 O21 Zn4C 1 c 117.0836; 16.9192; 21.0915
90; 110.954; 90
5693.1Kim, Yeonga; Song, Jeong Hwa; Lee, Woo Ram; Phang, Won Ju; Lim, Kwang Soo; Hong, Chang Seop
Reversible Structural Flexibility and Sensing Properties of a Zn(II) Metal‒Organic Framework: Phase Transformation between Interpenetrating 3D Net and 2D Sheet
Crystal Growth & Design, 2014, 14, 1933
4510337 CIFC32 H20 Cd1.25 N2 O6P 1 21/c 114.05; 20.156; 20.378
90; 101.717; 90
5650.6Zhang, Zhenjie; Wojtas, Lukasz; Zaworotko, Michael J.
Three Porphyrin-Encapsulating Metal‒Organic Materials with Ordered Metalloporphyrin Moieties
Crystal Growth & Design, 2014, 14, 1526
4510338 CIFC240 H180 Cd17 Cl4 N24 O87P -330.4643; 30.4643; 10.0841
90; 90; 120
8104.9Zhang, Zhenjie; Wojtas, Lukasz; Zaworotko, Michael J.
Three Porphyrin-Encapsulating Metal‒Organic Materials with Ordered Metalloporphyrin Moieties
Crystal Growth & Design, 2014, 14, 1526
4510339 CIFC30 H23 La N4 O10P 1 21/c 111.1578; 15.5651; 16.1486
90; 103.75; 90
2724.19Lu, Ying-Bing; Jian, Fang-Mei; Jin, Shuang; Zhao, Jun-Wei; Xie, Yong-Rong; Luo, Guo-Tian
Three-Dimensional Extended Frameworks Constructed from Dinuclear Lanthanide(III) 1,4-Naphthalenedicarboxylate Units with Bis(2,2′-biimidazole) Templates: Syntheses, Structures, and Magnetic and Luminescent Properties
Crystal Growth & Design, 2014, 14, 1684
4510340 CIFC30 H23 N4 O10 PrP 1 21/c 111.179; 15.482; 16.052
90; 103.943; 90
2696Lu, Ying-Bing; Jian, Fang-Mei; Jin, Shuang; Zhao, Jun-Wei; Xie, Yong-Rong; Luo, Guo-Tian
Three-Dimensional Extended Frameworks Constructed from Dinuclear Lanthanide(III) 1,4-Naphthalenedicarboxylate Units with Bis(2,2′-biimidazole) Templates: Syntheses, Structures, and Magnetic and Luminescent Properties
Crystal Growth & Design, 2014, 14, 1684
4510341 CIFC60 H43 N8 O18.5 Sm2P 1 21/c 123.0803; 15.5854; 15.6694
90; 103.898; 90
5471.5Lu, Ying-Bing; Jian, Fang-Mei; Jin, Shuang; Zhao, Jun-Wei; Xie, Yong-Rong; Luo, Guo-Tian
Three-Dimensional Extended Frameworks Constructed from Dinuclear Lanthanide(III) 1,4-Naphthalenedicarboxylate Units with Bis(2,2′-biimidazole) Templates: Syntheses, Structures, and Magnetic and Luminescent Properties
Crystal Growth & Design, 2014, 14, 1684
4510342 CIFC30 H21 Eu N4 O9P 1 21/c 111.7225; 15.7466; 15.4261
90; 104.63; 90
2755.17Lu, Ying-Bing; Jian, Fang-Mei; Jin, Shuang; Zhao, Jun-Wei; Xie, Yong-Rong; Luo, Guo-Tian
Three-Dimensional Extended Frameworks Constructed from Dinuclear Lanthanide(III) 1,4-Naphthalenedicarboxylate Units with Bis(2,2′-biimidazole) Templates: Syntheses, Structures, and Magnetic and Luminescent Properties
Crystal Growth & Design, 2014, 14, 1684
4510343 CIFC30 H21 Gd N4 O9P 1 21/c 111.7508; 15.7702; 15.359
90; 104.795; 90
2751.85Lu, Ying-Bing; Jian, Fang-Mei; Jin, Shuang; Zhao, Jun-Wei; Xie, Yong-Rong; Luo, Guo-Tian
Three-Dimensional Extended Frameworks Constructed from Dinuclear Lanthanide(III) 1,4-Naphthalenedicarboxylate Units with Bis(2,2′-biimidazole) Templates: Syntheses, Structures, and Magnetic and Luminescent Properties
Crystal Growth & Design, 2014, 14, 1684
4510344 CIFC30 H21 N4 O9 TbP 1 21/c 111.7438; 15.7457; 15.3042
90; 105.051; 90
2732.88Lu, Ying-Bing; Jian, Fang-Mei; Jin, Shuang; Zhao, Jun-Wei; Xie, Yong-Rong; Luo, Guo-Tian
Three-Dimensional Extended Frameworks Constructed from Dinuclear Lanthanide(III) 1,4-Naphthalenedicarboxylate Units with Bis(2,2′-biimidazole) Templates: Syntheses, Structures, and Magnetic and Luminescent Properties
Crystal Growth & Design, 2014, 14, 1684
4510345 CIFC30 H21 Dy N4 O9P 1 21/c 111.7439; 15.7292; 15.2552
90; 105.169; 90
2719.79Lu, Ying-Bing; Jian, Fang-Mei; Jin, Shuang; Zhao, Jun-Wei; Xie, Yong-Rong; Luo, Guo-Tian
Three-Dimensional Extended Frameworks Constructed from Dinuclear Lanthanide(III) 1,4-Naphthalenedicarboxylate Units with Bis(2,2′-biimidazole) Templates: Syntheses, Structures, and Magnetic and Luminescent Properties
Crystal Growth & Design, 2014, 14, 1684
4510346 CIFC30 H21 Er N4 O9P 1 21/c 111.7276; 15.693; 15.2043
90; 105.308; 90
2698.94Lu, Ying-Bing; Jian, Fang-Mei; Jin, Shuang; Zhao, Jun-Wei; Xie, Yong-Rong; Luo, Guo-Tian
Three-Dimensional Extended Frameworks Constructed from Dinuclear Lanthanide(III) 1,4-Naphthalenedicarboxylate Units with Bis(2,2′-biimidazole) Templates: Syntheses, Structures, and Magnetic and Luminescent Properties
Crystal Growth & Design, 2014, 14, 1684
4510347 CIFC24 H18 Cd3 O14P 1 21/c 19.5286; 9.7893; 13.7723
90; 107.421; 90
1225.73Cao, Li-Hui; Wei, Yong-Li; Yang, Yang; Xu, Hong; Zang, Shuang-Quan; Hou, Hong-Wei; Mak, Thomas C. W.
Crystal Structures and Properties of Cd(II) Coordination Polymers Supported by a New Chiral Aromatic Polycarboxylate Ligand
Crystal Growth & Design, 2014, 14, 1827
4510348 CIFC50 H46 Cd3 N4 O14C 1 2/c 116.9258; 10.7402; 27.8893
90; 105.97; 90
4874.2Cao, Li-Hui; Wei, Yong-Li; Yang, Yang; Xu, Hong; Zang, Shuang-Quan; Hou, Hong-Wei; Mak, Thomas C. W.
Crystal Structures and Properties of Cd(II) Coordination Polymers Supported by a New Chiral Aromatic Polycarboxylate Ligand
Crystal Growth & Design, 2014, 14, 1827
4510349 CIFC52 H50 Cd3 N8 O16C 1 2 114.6246; 12.9505; 14.8149
90; 108.622; 90
2659Cao, Li-Hui; Wei, Yong-Li; Yang, Yang; Xu, Hong; Zang, Shuang-Quan; Hou, Hong-Wei; Mak, Thomas C. W.
Crystal Structures and Properties of Cd(II) Coordination Polymers Supported by a New Chiral Aromatic Polycarboxylate Ligand
Crystal Growth & Design, 2014, 14, 1827
4510350 CIFC52 H46 Cd3 N8 O14C 1 2 118.7884; 10.2572; 13.2908
90; 99.863; 90
2523.5Cao, Li-Hui; Wei, Yong-Li; Yang, Yang; Xu, Hong; Zang, Shuang-Quan; Hou, Hong-Wei; Mak, Thomas C. W.
Crystal Structures and Properties of Cd(II) Coordination Polymers Supported by a New Chiral Aromatic Polycarboxylate Ligand
Crystal Growth & Design, 2014, 14, 1827
4510351 CIFC84 H84 Cd3 N18 O20P -110.3343; 13.2335; 17.7162
106.678; 92.95; 107.797
2184Cao, Li-Hui; Wei, Yong-Li; Yang, Yang; Xu, Hong; Zang, Shuang-Quan; Hou, Hong-Wei; Mak, Thomas C. W.
Crystal Structures and Properties of Cd(II) Coordination Polymers Supported by a New Chiral Aromatic Polycarboxylate Ligand
Crystal Growth & Design, 2014, 14, 1827
4510352 CIFC94 H106 Cd3 N10 O28P -19.9516; 15.7818; 16.5509
110.421; 101.582; 90.029
2379.37Cao, Li-Hui; Wei, Yong-Li; Yang, Yang; Xu, Hong; Zang, Shuang-Quan; Hou, Hong-Wei; Mak, Thomas C. W.
Crystal Structures and Properties of Cd(II) Coordination Polymers Supported by a New Chiral Aromatic Polycarboxylate Ligand
Crystal Growth & Design, 2014, 14, 1827
4510353 CIFC18 H12 N2 SeP 1 21/c 15.877; 19.574; 12.586
90; 97.791; 90
1434.5Pati, Palas Baran; Zade, Sanjio S.
Benzoselenadiazole Containing Donor–Acceptor–Donor Small Molecules: Nonbonding Interactions, Packing Patterns, and Optoelectronic Properties
Crystal Growth & Design, 2014, 14, 1695
4510354 CIFC14 H8 N2 S2 SeP 1 21/c 113.914; 5.2933; 18.897
90; 110.716; 90
1301.8Pati, Palas Baran; Zade, Sanjio S.
Benzoselenadiazole Containing Donor‒Acceptor‒Donor Small Molecules: Nonbonding Interactions, Packing Patterns, and Optoelectronic Properties
Crystal Growth & Design, 2014, 14, 1695
4510355 CIFC14 H8 N2 Se3P c a 2116.166; 12.751; 6.6381
90; 90; 90
1368.3Pati, Palas Baran; Zade, Sanjio S.
Benzoselenadiazole Containing Donor–Acceptor–Donor Small Molecules: Nonbonding Interactions, Packing Patterns, and Optoelectronic Properties
Crystal Growth & Design, 2014, 14, 1695
4510356 CIFC10 H13 N O5 SP 21 21 214.9709; 9.7703; 24.2865
90; 90; 90
1179.53Zolotarev, Pavel N.; Arshad, Muhammad Nadeem; Asiri, Abdullah M.; Al-amshany, Zahra M.; Blatov, Vladislav A.
A Possible Route toward Expert Systems in Supramolecular Chemistry: 2-Periodic H-Bond Patterns in Molecular Crystals
Crystal Growth & Design, 2014, 14, 1938
4510357 CIFC64 H64 N6 O30 Zn5P a -324.942; 24.942; 24.942
90; 90; 90
15517Chun, Hyungphil; Bak, Woojeong; Hong, Keunil; Moon, Dohyun
A Simple and Rational Approach for Binodal Metal‒Organic Frameworks with Tetrahedral Nodes and Unexpected Multimodal Porosities from Nonstoichiometric Defects
Crystal Growth & Design, 2014, 14, 1998
4510358 CIFC34 H40 N4 O18 Zn2P 63/m18.018; 18.018; 20.174
90; 90; 120
5672Chun, Hyungphil; Bak, Woojeong; Hong, Keunil; Moon, Dohyun
A Simple and Rational Approach for Binodal Metal‒Organic Frameworks with Tetrahedral Nodes and Unexpected Multimodal Porosities from Nonstoichiometric Defects
Crystal Growth & Design, 2014, 14, 1998
4510359 CIFC32 H28 F12 Fe2 N4 O4 S4C 1 2/c 112.323; 18.408; 18.015
90; 104.012; 90
3965Fornalczyk, Gregor; Valldor, Martin; Mathur, Sanjay
Monomeric Iron Heteroarylalkenolates: Structural Design Concepts and Investigations on Their Application in Chemical Vapor Deposition
Crystal Growth & Design, 2014, 14, 1811
4510360 CIFC20 H23 F6 Fe N2 O3 S2P -18.1848; 10.8195; 14.7741
76.019; 86.053; 70.005
1192.9Fornalczyk, Gregor; Valldor, Martin; Mathur, Sanjay
Monomeric Iron Heteroarylalkenolates: Structural Design Concepts and Investigations on Their Application in Chemical Vapor Deposition
Crystal Growth & Design, 2014, 14, 1811
4510361 CIFC7 H12 N4 OP 1 21/m 18.663; 6.5838; 9.0253
90; 116.56; 90
460.4Chesman, Anthony S. R.; Hodgson, Jennifer L.; Izgorodina, Ekaterina I.; Urbatsch, Aron; Turner, David R.; Deacon, Glen B.; Batten, Stuart R.
Anion‒Anion Interactions in the Crystal Packing of Functionalized Methanide Anions: An Experimental and Computational Study
Crystal Growth & Design, 2014, 14, 1922
4510362 CIFC7 H12 N4 O2P 1 21/c 111.5852; 15.6154; 11.3954
90; 109.555; 90
1942.6Chesman, Anthony S. R.; Hodgson, Jennifer L.; Izgorodina, Ekaterina I.; Urbatsch, Aron; Turner, David R.; Deacon, Glen B.; Batten, Stuart R.
Anion‒Anion Interactions in the Crystal Packing of Functionalized Methanide Anions: An Experimental and Computational Study
Crystal Growth & Design, 2014, 14, 1922
4510363 CIFC10 H12 N6 OC 1 2/c 111.5051; 16.5318; 6.3634
90; 93.046; 90
1208.61Chesman, Anthony S. R.; Hodgson, Jennifer L.; Izgorodina, Ekaterina I.; Urbatsch, Aron; Turner, David R.; Deacon, Glen B.; Batten, Stuart R.
Anion‒Anion Interactions in the Crystal Packing of Functionalized Methanide Anions: An Experimental and Computational Study
Crystal Growth & Design, 2014, 14, 1922
4510364 CIFC7 H14 N4 O3P 1 21/n 17.4023; 17.2639; 8.3753
90; 95.899; 90
1064.63Chesman, Anthony S. R.; Hodgson, Jennifer L.; Izgorodina, Ekaterina I.; Urbatsch, Aron; Turner, David R.; Deacon, Glen B.; Batten, Stuart R.
Anion‒Anion Interactions in the Crystal Packing of Functionalized Methanide Anions: An Experimental and Computational Study
Crystal Growth & Design, 2014, 14, 1922
4510365 CIFC3 H2 Ag N3 O3P 1 21/c 13.5082; 15.467; 9.685
90; 98.03; 90
520.37Chesman, Anthony S. R.; Hodgson, Jennifer L.; Izgorodina, Ekaterina I.; Urbatsch, Aron; Turner, David R.; Deacon, Glen B.; Batten, Stuart R.
Anion‒Anion Interactions in the Crystal Packing of Functionalized Methanide Anions: An Experimental and Computational Study
Crystal Growth & Design, 2014, 14, 1922
4510366 CIFC8 H7 Cl O3P 1 21/c 18.6101; 10.4552; 9.3914
90; 93.69; 90
843.66Coles, Simon J.; Threlfall, Terence L.; Tizzard, Graham J.
The Same but Different: Isostructural Polymorphs and the Case of 3-Chloromandelic Acid
Crystal Growth & Design, 2014, 14, 1623
4510367 CIFC8 H7 Cl O3P -18.571; 9.2373; 10.3612
91.818; 90.226; 93.118
818.69Coles, Simon J.; Threlfall, Terence L.; Tizzard, Graham J.
The Same but Different: Isostructural Polymorphs and the Case of 3-Chloromandelic Acid
Crystal Growth & Design, 2014, 14, 1623
4510368 CIFC28 H20 O10 Pb4F d d 231.9415; 36.1537; 10.8862
90; 90; 90
12571.4Easterday, Clay C.; Dedon, Liv R.; Zeller, Matthias; Oertel, Catherine M.
Helical∞1[Pb2O] Chains in Polymorphs of Pb2O(C6H5COO)2
Crystal Growth & Design, 2014, 14, 2048
4510369 CIFC56 H40 O20 Pb8P 1 21 110.7791; 22.9541; 24.1692
90; 90.212; 90
5980Easterday, Clay C.; Dedon, Liv R.; Zeller, Matthias; Oertel, Catherine M.
Helical∞1[Pb2O] Chains in Polymorphs of Pb2O(C6H5COO)2
Crystal Growth & Design, 2014, 14, 2048
4510370 CIFC42 H30 O13 Pb4C 1 2/c 113.263; 22.855; 13.483
90; 97.923; 90
4048Easterday, Clay C.; Dedon, Liv R.; Zeller, Matthias; Oertel, Catherine M.
Helical∞1[Pb2O] Chains in Polymorphs of Pb2O(C6H5COO)2
Crystal Growth & Design, 2014, 14, 2048
4510371 CIFC16 H21 N3 O3P 1 21/n 114.0905; 6.2506; 17.017
90; 91.321; 90
1498.36Braun, Doris E.; McMahon, Jennifer A.; Koztecki, Lien H.; Price, Sarah L.; Reutzel-Edens, Susan M.
Contrasting Polymorphism of Related Small Molecule Drugs Correlated and Guided by the Computed Crystal Energy Landscape
Crystal Growth & Design, 2014, 14, 2056
4510372 CIFC22 H25 N3 O3P -19.397; 10.8925; 11.0095
65.728; 67.321; 77.584
945.71Braun, Doris E.; McMahon, Jennifer A.; Koztecki, Lien H.; Price, Sarah L.; Reutzel-Edens, Susan M.
Contrasting Polymorphism of Related Small Molecule Drugs Correlated and Guided by the Computed Crystal Energy Landscape
Crystal Growth & Design, 2014, 14, 2056
4510373 CIFC22 H25 N3 O3P -19.2754; 10.0504; 11.858
106.01; 108.236; 99.895
967.99Braun, Doris E.; McMahon, Jennifer A.; Koztecki, Lien H.; Price, Sarah L.; Reutzel-Edens, Susan M.
Contrasting Polymorphism of Related Small Molecule Drugs Correlated and Guided by the Computed Crystal Energy Landscape
Crystal Growth & Design, 2014, 14, 2056

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