Crystallography Open Database

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4131890 CIFC88 H142 N8 Ni2 O12P 1 21 110.9543; 23.5971; 20.4838
90; 95.962; 90
5266.2Lin, Xiaobin; Tang, Yu; Yang, Wei; Tan, Fei; Lin, Lili; Liu, Xiaohua; Feng, Xiaoming
Chiral Nickel(II) Complex Catalyzed Enantioselective Doyle-Kirmse Reaction of α-Diazo Pyrazoleamides.
Journal of the American Chemical Society, 2018, 140, 3299-3305
4131891 CIFC8 H12 Br6 Cd N2P n m a12.783; 9.491; 17.67
90; 90; 90
2144Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; You, Yu-Meng; Xiong, Ren-Gen
Competitive Halogen Bond in the Molecular Ferroelectric with Large Piezoelectric Response.
Journal of the American Chemical Society, 2018, 140, 3975-3980
4131892 CIFC4 H11 Br3 Cd Cl NP 63/m m c9.59; 9.59; 7.0146
90; 90; 120
558.69Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; You, Yu-Meng; Xiong, Ren-Gen
Competitive Halogen Bond in the Molecular Ferroelectric with Large Piezoelectric Response.
Journal of the American Chemical Society, 2018, 140, 3975-3980
4131893 CIFC4 H11 Br3 Cd Cl NP 63 m c9.514; 9.514; 7.0191
90; 90; 120
550.22Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; You, Yu-Meng; Xiong, Ren-Gen
Competitive Halogen Bond in the Molecular Ferroelectric with Large Piezoelectric Response.
Journal of the American Chemical Society, 2018, 140, 3975-3980
4131894 CIFC4 H11 Br3 Cd Cl NP 63 m c9.402; 9.402; 6.977
90; 90; 120
534.1Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; You, Yu-Meng; Xiong, Ren-Gen
Competitive Halogen Bond in the Molecular Ferroelectric with Large Piezoelectric Response.
Journal of the American Chemical Society, 2018, 140, 3975-3980
4131895 CIFC16 H44 Br12 Cd2 N4P 1 21/c 19.539; 17.604; 12.628
90; 92.695; 90
2118Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; You, Yu-Meng; Xiong, Ren-Gen
Competitive Halogen Bond in the Molecular Ferroelectric with Large Piezoelectric Response.
Journal of the American Chemical Society, 2018, 140, 3975-3980
4131896 CIFC17 H9 N2 S2P 1 21 17.3514; 8.0601; 21.3723
90; 94.7647; 90
1262Beldjoudi, Yassine; Nascimento, Mitchell A.; Cho, Yong Joo; Yu, Hyeonghwa; Aziz, Hany; Tonouchi, Daiki; Eguchi, Keitaro; Matsushita, Michio M.; Awaga, Kunio; Osorio-Roman, Igor; Constantinides, Christos P.; Rawson, Jeremy M.
Multifunctional Dithiadiazolyl Radicals: Fluorescence, Electroluminescence, and Photoconducting Behavior in Pyren-1'-yl-dithiadiazolyl.
Journal of the American Chemical Society, 2018, 140, 6260-6270
4131897 CIFC25 H28 Cu F3 N5 O6 SP 1 21/n 17.3589; 19.2305; 19.2279
90; 93.221; 90
2716.74Nijs, Thomas; Klein, Y. Maximilian; Mousavi, S. Fatemeh; Ahsan, Aisha; Nowakowska, Sylwia; Constable, Edwin C.; Housecroft, Catherine E.; Jung, Thomas A.
The Different Faces of 4'-Pyrimidinyl-Functionalized 4,2':6',4''-Terpyridines: Metal-Organic Assemblies from Solution and on Au(111) and Cu(111) Surface Platforms.
Journal of the American Chemical Society, 2018, 140, 2933-2939
4131898 CIFC29 H29 Cu2 N5 O8C 1 2/c 126.0869; 14.8694; 8.1356
90; 108.012; 90
3001.1Nijs, Thomas; Klein, Y. Maximilian; Mousavi, S. Fatemeh; Ahsan, Aisha; Nowakowska, Sylwia; Constable, Edwin C.; Housecroft, Catherine E.; Jung, Thomas A.
The Different Faces of 4'-Pyrimidinyl-Functionalized 4,2':6',4''-Terpyridines: Metal-Organic Assemblies from Solution and on Au(111) and Cu(111) Surface Platforms.
Journal of the American Chemical Society, 2018, 140, 2933-2939
4131899 CIFC17 H24 N2 O2P 1 21 112.1758; 10.373; 14.1803
90; 112.952; 90
1649.18Song, Jin; Zhang, Zi-Jing; Chen, Shu-Sen; Fan, Tao; Gong, Liu-Zhu
Lewis Base/Copper Cooperatively Catalyzed Asymmetric α-Amination of Esters with Diaziridinone.
Journal of the American Chemical Society, 2018, 140, 3177-3180
4131900 CIFC188 H142 Eu4 F36 N12 O35C 1 2 125.7797; 34.9694; 12.4506
90; 101.77; 90
10988.2Bing, Tan Yan; Kawai, Tsuyoshi; Yuasa, Junpei
Ligand-to-Ligand Interactions That Direct Formation of D<sub>2</sub>-Symmetrical Alternating Circular Helicate.
Journal of the American Chemical Society, 2018, 140, 3683-3689
4131901 CIFC184 H128 F36 N12 O36 Yb4C 1 2 133.7188; 32.0387; 22.5439
90; 102.13; 90
23810.6Bing, Tan Yan; Kawai, Tsuyoshi; Yuasa, Junpei
Ligand-to-Ligand Interactions That Direct Formation of D<sub>2</sub>-Symmetrical Alternating Circular Helicate.
Journal of the American Chemical Society, 2018, 140, 3683-3689
4131902 CIFC184 H132 F36 N12 O34 Sm4C 1 2 125.759; 35.1455; 12.463
90; 102.001; 90
11036.3Bing, Tan Yan; Kawai, Tsuyoshi; Yuasa, Junpei
Ligand-to-Ligand Interactions That Direct Formation of D<sub>2</sub>-Symmetrical Alternating Circular Helicate.
Journal of the American Chemical Society, 2018, 140, 3683-3689
4131903 CIFC184 H132 Eu4 F36 N12 O34C 1 2 125.7603; 35.035; 12.4435
90; 101.626; 90
11000Bing, Tan Yan; Kawai, Tsuyoshi; Yuasa, Junpei
Ligand-to-Ligand Interactions That Direct Formation of D<sub>2</sub>-Symmetrical Alternating Circular Helicate.
Journal of the American Chemical Society, 2018, 140, 3683-3689
4131904 CIFC184 H128 F36 N12 O36 Yb4C 1 2 133.9451; 31.7821; 22.4739
90; 102.275; 90
23691.6Bing, Tan Yan; Kawai, Tsuyoshi; Yuasa, Junpei
Ligand-to-Ligand Interactions That Direct Formation of D<sub>2</sub>-Symmetrical Alternating Circular Helicate.
Journal of the American Chemical Society, 2018, 140, 3683-3689
4131905 CIFC187 H112 F36 N12 O44 Y4C 1 2 133.7309; 32.1542; 22.2394
90; 101.685; 90
23620.8Bing, Tan Yan; Kawai, Tsuyoshi; Yuasa, Junpei
Ligand-to-Ligand Interactions That Direct Formation of D<sub>2</sub>-Symmetrical Alternating Circular Helicate.
Journal of the American Chemical Society, 2018, 140, 3683-3689
4131906 CIFC250.03 H329.15 Cl16.96 N32 O38.38 Tb2P -117.3755; 19.9053; 22.8678
64.5031; 88.255; 75.2468
6875.1Morita, Takaumi; Damjanović, Marko; Katoh, Keiichi; Kitagawa, Yasutaka; Yasuda, Nobuhiro; Lan, Yanhua; Wernsdorfer, Wolfgang; Breedlove, Brian K.; Enders, Markus; Yamashita, Masahiro
Comparison of the Magnetic Anisotropy and Spin Relaxation Phenomenon of Dinuclear Terbium(III) Phthalocyaninato Single-Molecule Magnets Using the Geometric Spin Arrangement.
Journal of the American Chemical Society, 2018, 140, 2995-3007
4131907 CIFC38.52 H35.81 Cl Fe N4 O7.38P -110.0679; 12.6568; 15.6766
98.834; 106.858; 104.372
1796.31Pangia, Thomas M.; Davies, Casey G.; Prendergast, Joshua R.; Gordon, Jesse B.; Siegler, Maxime A.; Jameson, Guy N. L.; Goldberg, David P.
Observation of Radical Rebound in a Mononuclear Nonheme Iron Model Complex.
Journal of the American Chemical Society, 2018, 140, 4191-4194
4131908 CIFC39.38 H35.62 Cl Fe N5.38 O5.62P 1 21/n 110.112; 22.0629; 16.4935
90; 104.954; 90
3555.08Pangia, Thomas M.; Davies, Casey G.; Prendergast, Joshua R.; Gordon, Jesse B.; Siegler, Maxime A.; Jameson, Guy N. L.; Goldberg, David P.
Observation of Radical Rebound in a Mononuclear Nonheme Iron Model Complex.
Journal of the American Chemical Society, 2018, 140, 4191-4194
4131909 CIFC39 H46 B F2 N3 O4P 1 21/c 115.6805; 10.4626; 21.9659
90; 101.322; 90
3533.6Collot, Mayeul; Fam, Tkhe Kyong; Ashokkumar, Pichandi; Faklaris, Orestis; Galli, Thierry; Danglot, Lydia; Klymchenko, Andrey S.
Ultrabright and Fluorogenic Probes for Multicolor Imaging and Tracking of Lipid Droplets in Cells and Tissues.
Journal of the American Chemical Society, 2018, 140, 5401-5411
4131910 CIFC44 H4.6 O44.5 Zr6C 1 2 120.747; 20.747; 14.67
90; 135; 90
4465Albalad, Jorge; Xu, Heng; Gándara, Felipe; Haouas, Mohamed; Martineau-Corcos, Charlotte; Mas-Ballesté, Rubén; Barnett, Sarah A.; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel
Single-Crystal-to-Single-Crystal Postsynthetic Modification of a Metal-Organic Framework via Ozonolysis.
Journal of the American Chemical Society, 2018, 140, 2028-2031
4131911 CIFC49 H63 F24 N10 O7 P4 S5P -114.493; 14.921; 17.665
100.095; 107.797; 98.626
3495Wu, Ren-Tsung; Chi, Xiaodong; Hirao, Takehiro; Lynch, Vincent M.; Sessler, Jonathan L.
Supramolecular Properties of a Monocarboxylic Acid-Functionalized "Texas-Sized" Molecular Box.
Journal of the American Chemical Society, 2018, 140, 6823-6831
4131912 CIFC43 H33 F18 N10 O4 P3 S2P n m a27.323; 31.177; 11.9178
90; 90; 90
10152Wu, Ren-Tsung; Chi, Xiaodong; Hirao, Takehiro; Lynch, Vincent M.; Sessler, Jonathan L.
Supramolecular Properties of a Monocarboxylic Acid-Functionalized "Texas-Sized" Molecular Box.
Journal of the American Chemical Society, 2018, 140, 6823-6831
4131913 CIFC26 H54 Ca2 I2 O6P n a 2119.866; 7.7093; 22.122
90; 90; 90
3388Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Dimethylcalcium.
Journal of the American Chemical Society, 2018, 140, 2373-2383
4131914 CIFC29.92 H64.75 Ca3 I1.08 O5P 1 21/n 112.223; 17.635; 18.194
90; 93.383; 90
3915Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Dimethylcalcium.
Journal of the American Chemical Society, 2018, 140, 2373-2383
4131915 CIFC55 H88 B2 Ca N12P -111.864; 12.059; 20.598
96.07; 95.89; 99.03
2873Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Dimethylcalcium.
Journal of the American Chemical Society, 2018, 140, 2373-2383
4131916 CIFC62 H110 B2 Ca2 N12 O3P -111.6278; 15.9075; 19.5703
79.691; 80.461; 80.899
3481.3Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Dimethylcalcium.
Journal of the American Chemical Society, 2018, 140, 2373-2383
4131917 CIFC30 H53 B Ca N6 OP 1 21/n 122.2039; 12.3521; 27.028
90; 101.36; 90
7267.6Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Dimethylcalcium.
Journal of the American Chemical Society, 2018, 140, 2373-2383
4131918 CIFC55 H108 Ca2 O6P 1 21 112.3787; 19.6198; 12.7078
90; 111.5; 90
2871.6Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Dimethylcalcium.
Journal of the American Chemical Society, 2018, 140, 2373-2383
4131919 CIFC52.5 H105.5 Ca2 O5P 1 21/n 113.0501; 19.3522; 22.1731
90; 92.027; 90
5596.3Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Dimethylcalcium.
Journal of the American Chemical Society, 2018, 140, 2373-2383
4131920 CIFC8 H24 Ca Ga2C m c 217.388; 19.802; 9.63
90; 90; 90
1408.8Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner
Dimethylcalcium.
Journal of the American Chemical Society, 2018, 140, 2373-2383
4131921 CIFC27 H19 N2 PC 1 2 115.317; 8.924; 16.982
90; 111.376; 90
2161.6Hashimoto, Naoki; Umano, Rika; Ochi, Yusuke; Shimahara, Kiyoka; Nakamura, Jun; Mori, Shigeki; Ohta, Hidetoshi; Watanabe, Yutaka; Hayashi, Minoru
Synthesis and Photophysical Properties of λ<sup>5</sup>-Phosphinines as a Tunable Fluorophore.
Journal of the American Chemical Society, 2018, 140, 2046-2049
4131922 CIFC19 H13 N2 PC 1 2 115.138; 9.219; 28.143
90; 100.742; 90
3859Hashimoto, Naoki; Umano, Rika; Ochi, Yusuke; Shimahara, Kiyoka; Nakamura, Jun; Mori, Shigeki; Ohta, Hidetoshi; Watanabe, Yutaka; Hayashi, Minoru
Synthesis and Photophysical Properties of λ<sup>5</sup>-Phosphinines as a Tunable Fluorophore.
Journal of the American Chemical Society, 2018, 140, 2046-2049
4131923 CIFC21 H21 N O5P -16.4957; 9.6763; 14.8709
97.388; 95.474; 100.439
904.82Wang, Gang-Wei; Bower, John F.
Modular Access to Azepines by Directed Carbonylative C-C Bond Activation of Aminocyclopropanes.
Journal of the American Chemical Society, 2018, 140, 2743-2747
4131924 CIFC276 H288 Cl6 N6 Ni18 O36 S30P -118.052; 23.231; 26.344
70.236; 77.675; 86.573
10156Wang, Shentang; Gao, Xiaohui; Hang, Xinxin; Zhu, Xiaofei; Han, Haitao; Li, Xiaokun; Liao, Wuping; Chen, Wei
Calixarene-Based {Ni<sub>18</sub>} Coordination Wheel: Highly Efficient Electrocatalyst for the Glucose Oxidation and Template for the Homogenous Cluster Fabrication.
Journal of the American Chemical Society, 2018, 140, 6271-6277
4131925 CIFC10 H20 Cl2 Cu N16 O8C 1 2/c 115.0672; 9.0113; 17.5426
90; 97.696; 90
2360.39Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg
Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion.
Journal of the American Chemical Society, 2018, 140, 3206-3209
4131926 CIFC8 H20 Cl2 Cu N20 O6P 1 21/n 113.1028; 10.7288; 16.2265
90; 95.036; 90
2272.3Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg
Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion.
Journal of the American Chemical Society, 2018, 140, 3206-3209
4131927 CIFC8 H16 Cl2 Cu N16 O6P 1 21/n 17.6403; 10.0072; 13.623
90; 90.4; 90
1041.56Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg
Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion.
Journal of the American Chemical Society, 2018, 140, 3206-3209
4131928 CIFC10 H16 Cl2 Cu N16 O6C 1 2/c 114.6638; 8.9883; 16.3538
90; 90.324; 90
2155.44Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg
Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion.
Journal of the American Chemical Society, 2018, 140, 3206-3209
4131929 CIFC10 H16 Cl2 Cu N16 O6P -16.7837; 8.182; 10.1959
108.068; 101.188; 90.137
526.6Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg
Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion.
Journal of the American Chemical Society, 2018, 140, 3206-3209
4131930 CIFC6 H12 Cl2 Cu N12 O6C 1 2/m 113.5622; 15.5713; 7.7338
90; 91.559; 90
1632.6Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg
Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion.
Journal of the American Chemical Society, 2018, 140, 3206-3209
4131931 CIFC12 H20 Cl2 Cu N16 O6P 1 21/n 110.7286; 6.8178; 15.5263
90; 100.469; 90
1116.77Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg
Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion.
Journal of the American Chemical Society, 2018, 140, 3206-3209
4131932 CIFC4 H14 Cl2 Cu N10 O8P -16.5617; 7.526; 9.0097
111.762; 98.711; 104.197
385.81Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg
Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion.
Journal of the American Chemical Society, 2018, 140, 3206-3209
4131933 CIFC8 H16 Cl2 Cu N16 O6P -17.2932; 10.9456; 12.417
93.041; 96.845; 91.156
982.43Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg
Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion.
Journal of the American Chemical Society, 2018, 140, 3206-3209
4131934 CIFC15 H24 Cl2 Cu N24 O6P -3 c 110.9642; 10.9642; 14.3772
90; 90; 120
1496.78Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg
Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion.
Journal of the American Chemical Society, 2018, 140, 3206-3209
4131935 CIFC57 H72 Ce N9R -3 c :H18.626; 18.626; 55.983
90; 90; 120
16820Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J.
Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores.
Journal of the American Chemical Society, 2018, 140, 4588-4595
4131936 CIFC36 H72 Ce N9P -110.0315; 11.8803; 17.842
82.423; 85.788; 89.638
2102.09Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J.
Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores.
Journal of the American Chemical Society, 2018, 140, 4588-4595
4131937 CIFC39 H84 Ce N9P 1 21/c 113.2861; 19.9413; 18.6655
90; 109.946; 90
4648.6Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J.
Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores.
Journal of the American Chemical Society, 2018, 140, 4588-4595
4131938 CIFC48 H96 Ce N9C 1 2/c 124.249; 13.9439; 18.4167
90; 115.072; 90
5640.4Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J.
Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores.
Journal of the American Chemical Society, 2018, 140, 4588-4595
4131939 CIFC42 H96 Ce N9 Si3P 1 21/c 112.8493; 10.7028; 39.41
90; 93.013; 90
5412.3Qiao, Yusen; Sergentu, Dumitru-Claudiu; Yin, Haolin; Zabula, Alexander V.; Cheisson, Thibault; McSkimming, Alex; Manor, Brian C.; Carroll, Patrick J.; Anna, Jessica M.; Autschbach, Jochen; Schelter, Eric J.
Understanding and Controlling the Emission Brightness and Color of Molecular Cerium Luminophores.
Journal of the American Chemical Society, 2018, 140, 4588-4595

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