Crystallography Open Database

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1546200 CIFC30.5 H60.33333 O5.83333P 114.9136; 14.9888; 22.7918
97.926; 93.125; 114.454
4558.1Niu, Biao; Ke, Chang-Qiang; Li, Bo-Han; Li, Yuanyuan; Yi, Yongji; Luo, Yongwei; Shuai, Lin; Yao, Sheng; Lin, Li-Gen; Li, Jia; Ye, Yang
Cucurbitane Glucosides from the Crude Extract of Siraitia grosvenorii with Moderate Effects on PGC-1α Promoter Activity.
Journal of natural products, 2017, 80, 1428-1435
1546516 CIFC11 H12 F3 N OP 15.0215; 8.6681; 12.6928
80.344; 83.072; 88.4
540.66Noto, Naoki; Koike, Takashi; Akita, Munetaka
Metal-free di- and tri-fluoromethylation of alkenes realized by visible-light-induced perylene photoredox catalysis
Chem. Sci., 2017
1546664 CIF
HKL
Paper
C67 H72 B Br Fe N2 O P2P 112.8083; 14.637; 18.9082
106.916; 98.406; 110.635
3048.9Smith, Samantha A. M.; Lough, Alan J.; Morris, Robert H.
Bromidocarbonyl{(1<i>S</i>,2<i>S</i>)-<i>N</i>-[2-(dicyclohexylphosphanyl)ethylidenyl]-<i>N</i>'-[2-(diphenylphosphanyl)ethyl]-1,2-diphenylethane-1,2-diamine}iron(II) tetraphenylborate
IUCrData, 2017, 2, x170452
1546750 CIFC71 H60 B Br Fe N2 O P2P 111.301; 14.448; 19.278
110.941; 97.709; 101.33
2809.8Demmans, Karl Z.; Seo, Chris S. G.; Lough, Alan J.; Morris, Robert H.
From imine to amine: an unexpected left turn. Cis-β iron(ii) PNNP′ precatalysts for the asymmetric transfer hydrogenation of acetophenone
Chem. Sci., 2017
1546779 CIFC25 H37 F O5P 16.6282; 12.7871; 29.3443
81.5019; 84.6748; 75.0869
2373.02Bume, Desta Doro; Pitts, Cody Ross; Ghorbani, Fereshte; Harry, Stefan Andrew; Capilato, Joseph N.; Siegler, Maxime A.; Lectka, Thomas
Ketones as Directing Groups in Photocatalytic sp3 C-H Fluorination
Chem. Sci., 2017
1546958 CIFC18 H16 O5P 15.088; 11.946; 23.4043
90; 90; 90
1422.54Xu, Liangxiong; Wu, Ping; Xue, Jinghua; Molnar, Istvan; Wei, Xiaoyi
Antifungal and Cytotoxic β-Resorcylic Acid Lactones from a Paecilomyces Species.
Journal of natural products, 2017, 80, 2215-2223
1547020 CIFC24 H29 Cl2 N O4P 17.3804; 9.68; 16.898
87.64; 86.23; 89.091
1203.5Fan, Shiming; Liu, Shouxin; Zhu, Sufang; Feng, Juan; Zhang, Zhiwei; Huang, Jing
Temperature-Dependent Enantio- and Diastereodivergent Synthesis of Amino Acids with One or Multiple Chiral Centers.
Organic letters, 2017, 19, 4660-4663
1547024 CIFC16 H25 N O3P 110.9576; 10.9859; 13.5339
99.194; 98.907; 102.923
1536.48Fan, Shiming; Liu, Shouxin; Zhu, Sufang; Feng, Juan; Zhang, Zhiwei; Huang, Jing
Temperature-Dependent Enantio- and Diastereodivergent Synthesis of Amino Acids with One or Multiple Chiral Centers.
Organic letters, 2017, 19, 4660-4663
1547081 CIFC17 H18 N4 O3P 18.8973; 10.3854; 10.5682
113.149; 92.819; 112.907
803.17Bernar, Ivan; Fiser, Béla; Blanco-Ania, Daniel; Gómez-Bengoa, Enrique; Rutjes, Floris P. J. T.
Pd-Catalyzed Hydroamination of Alkoxyallenes with Azole Heterocycles: Examples and Mechanistic Proposal.
Organic letters, 2017, 19, 4211-4214
1547089 CIFC19 H25 N3 O7 SP 15.8603; 8.7507; 19.9834
95.115; 90.454; 97.456
1011.87Prasad, Sure Siva; Senthilkumar, Soundararasu; Srivastava, Akriti; Baskaran, Sundarababu
Iminosugar C-Nitromethyl Glycosides and Divergent Synthesis of Bicyclic Iminosugars.
Organic letters, 2017, 19, 4403-4406
1547093 CIFC21 H22 N2 O7P 17.5; 10.984; 12.966
79.535; 87.356; 75.611
1017.4Read, Jacquelyne A.; Yang, Yingying; Woerpel, K. A.
Additions of Organomagnesium Halides to α-Alkoxy Ketones: Revision of the Chelation-Control Model.
Organic letters, 2017, 19, 3346-3349
1547125 CIFC26 H26 N4 O5P 17.2089; 8.081; 20.594
81.103; 84.522; 84.478
1175.8Kadam, Abhishek A.; Ellern, Arkady; Stanley, Levi M.
Enantioselective, Palladium-Catalyzed Conjugate Additions of Arylboronic Acids to Form Bis-benzylic Quaternary Stereocenters.
Organic letters, 2017, 19, 4062-4065
1547230 CIFC19 H19 N OP 18.4979; 9.606; 9.7613
90.716; 105.714; 100.679
752.1Hu, Yue; Huang, Hanmin
Highly Selective Construction of Medium-Sized Lactams by Palladium-Catalyzed Intramolecular Hydroaminocarbonylation of Aminoalkynes.
Organic letters, 2017, 19, 5070-5073
1547565 CIFC46 H11 Cl5 F20 S4P 18.198; 10.441; 13.934
101.832; 96.687; 104.041
1115Panchal, Santosh P.; Anand, Venkataramanarao G.
Oxidative Transformation of a Tetrathia S-Confused Isophlorin into Porphyrin Cation.
Organic letters, 2017, 19, 4854-4857
1547567 CIFC15 H14 O3 SP 17.8451; 8.3042; 11.06
76.583; 88.533; 75.925
679.46Xia, Jingzhao; Nie, Yu; Yang, Guoqiang; Liu, Yangang; Zhang, Wanbin
Iridium-Catalyzed Asymmetric Hydrogenation of 2H-Chromenes: A Highly Enantioselective Approach to Isoflavan Derivatives.
Organic letters, 2017, 19, 4884-4887
1547576 CIFC21 H19 Br N2 O6P 17.04; 7.063; 10.762
83.24; 79.64; 79.5
515.6Yuan, Yang; Yu, Bo; Bai, Xing-Feng; Xu, Zheng; Zheng, Zhan-Jiang; Cui, Yu-Ming; Cao, Jian; Xu, Li-Wen
Asymmetric Synthesis of Glutamic Acid Derivatives by Silver-Catalyzed Conjugate Addition-Elimination Reactions.
Organic letters, 2017, 19, 4896-4899
1547701 CIFC21 H28 Br N O7P 15.8465; 9.7587; 9.8846
89.343; 87.738; 86.3034
562.324Horwitz, Matthew A.; Fulton, Jennifer L.; Johnson, Jeffrey S.
Enantio- and Diastereoselective Organocatalytic Conjugate Additions of Nitroalkanes to Enone Diesters.
Organic letters, 2017, 19, 5783-5785
1547853 CIFC19.5 H27 N2 O2P 19.0112; 9.8045; 10.2163
89.964; 78.459; 76.61
859.33Chong, Kam-Weng; Yeap, Joanne Soon-Yee; Lim, Siew-Huah; Weber, Jean-Frédéric F; Low, Yun-Yee; Kam, Toh-Seok
Biosynthetic Enantiodivergence in the Eburnane Alkaloids from Kopsia.
Journal of natural products, 2017, 80, 3014-3024
1547893 CIFC41 H72.5 N7 O13.25P 111.0081; 11.0439; 20.174
81.37; 78.531; 80.367
2352.4Sudipta Mondal; Maxim Varenik; Daniel Nir Bloch; Yoav Atsmon-Raz; Guy Jacoby; Lihi Adler-Abramovich; Linda J.W. Shimon; Roy Beck; Yifat Miller; Oren Regev; Ehud Gazit
A minimal length rigid helical peptide motif allows rational design of modular surfactants
Nature Communications, 2017, 8, 14018
1547898 CIFC20 H50 Al2 Cl12 Mg3 O10P 112.3498; 16.4651; 35.607
80.016; 81.571; 85.031
7039.7Salama, Michael; Shterenberg, Ivgeni; J.W. Shimon, Linda; Keinan-Adamsky, Keren; Afri, Michal; Gofer, Yosef; Aurbach, Doron
Structural Analysis of Magnesium Chloride Complexes in Dimethoxyethane Solutions in the Context of Mg Batteries Research
The Journal of Physical Chemistry C, 2017, 121, 24909
1547925 CIFC21 H21 N OP 16.1157; 7.6877; 35.725
88.193; 85.251; 82.371
1658.7Lim, Ngiap-Kie; Weiss, Patrick; Li, Beryl X.; McCulley, Christina H.; Hare, Stephanie R.; Bensema, Bronwyn L.; Palazzo, Teresa A.; Tantillo, Dean J.; Zhang, Haiming; Gosselin, Francis
Synthesis of Highly Stereodefined Tetrasubstituted Acyclic All-Carbon Olefins via a Syn-Elimination Approach.
Organic letters, 2017, 19, 6212-6215
1548037 CIFC30 H50 N6 O9P 14.9205; 11.812; 14.637
99.369; 93.376; 98.82
826.4Tom Guterman; Micha Kornreich; Avigail Stern; Lihi Adler-Abramovich; Danny Porath; Roy Beck; Linda J. W. Shimon; Ehud Gazit
Formation of bacterial pilus-like nanofibres by designed minimalistic self-assembling peptides
Nature Communications, 2016, 7, 13482
1548075 CIFC38 H80 As2 Ge2 K2 N6 O12P 110.9738; 11.9313; 12.6146
118.021; 108.361; 96.476
1315.07Stefan Mitzinger; Lies Broeckaert; Werner Massa; Florian Weigend; Stefanie Dehnen
Understanding of multimetallic cluster growth
Nature Communications, 2016, 7, 10480
1548294 CIFC27 H26 O5 SP 14.6598; 11.2839; 12.0321
115.307; 97.601; 94.255
560.85Pratap S. Patil; Ting-Jen Rachel Cheng; Medel Manuel L. Zulueta; Shih-Ting Yang; Larry S. Lico; Shang-Cheng Hung
Total synthesis of tetraacylated phosphatidylinositol hexamannoside and evaluation of its immunomodulatory activity
Nature Communications, 2015, 6, 7239
1548328 CIFC20 H17 N O2P 17.3007; 10.496; 10.861
70.26; 77; 81.658
761.1Zhang, Dewu; Guo, Jiamei; Zhang, Min; Liu, Xiao; Ba, Mingyu; Tao, Xiaoyu; Yu, Liyan; Guo, Ying; Dai, Jungui
Oxazole-Containing Diterpenoids from Cell Cultures of Salvia miltiorrhiza and Their Anti-HIV-1 Activities.
Journal of natural products, 2017, 80, 3241-3246
1548358 CIFC21 H28 Cl6 O3P 16.315; 9.3352; 11.1622
104.386; 95.464; 107.774
596.44Mino R. Caira; Susan A. Bourne; Halima Samsodien
Thermal, X-ray Structural, and Dissolution Characteristics of Solid Forms Derived from the Anticancer Agents 2-Methoxyestradiol and 2-Methoxyestradiol-3,17-O,O-Bis-Sulfamate
Journal of Pharmaceutical Sciences, 2015, 104, 3418-3425
1548386 CIFC58 H53 Ag5 F6 N17 O6 S2P 112.278; 25.145; 12.408
90; 117.31; 90
3403.7He, Xin; Xue, Yang; Li, Cui-Cui; Wang, Yuechao; Jiang, Hong; Zhao, Liang
Synthesis of stable polymetalated aromatic complexes through metal-macrocycle capsule-triggered cyclization.
Chemical science, 2018, 9, 1481-1487
1548394 CIFBi9 Mn5.571 O20.143P 127.72; 27.72; 39.4
90; 90; 120
26218.8Li, Leigang; Boullay, Philippe; Lu, Ping; Wang, Xuejing; Jian, Jie; Huang, Jijie; Gao, Xingyao; Misra, Shikhar; Zhang, Wenrui; Perez, Olivier; Steciuk, Gwladys; Chen, Aiping; Zhang, Xinghang; Wang, Haiyan
Novel Layered Supercell Structure from Bi2AlMnO6 for Multifunctionalities.
Nano letters, 2017, 17, 6575-6582
1548395 CIFBi9 Mn5.571 O20.143P 127.72; 27.72; 78.8
90; 90; 120
52437.7Li, Leigang; Boullay, Philippe; Lu, Ping; Wang, Xuejing; Jian, Jie; Huang, Jijie; Gao, Xingyao; Misra, Shikhar; Zhang, Wenrui; Perez, Olivier; Steciuk, Gwladys; Chen, Aiping; Zhang, Xinghang; Wang, Haiyan
Novel Layered Supercell Structure from Bi2AlMnO6 for Multifunctionalities.
Nano letters, 2017, 17, 6575-6582
1548480 CIFC10 H16 N O3P 15.0728; 14.5938; 15.1058
83.648; 81.203; 83.714
1093.47Milan Bergeron-Brlek; Michael Meanwell; Robert Britton
Direct synthesis of imino-C-nucleoside analogues and other biologically active iminosugars
Nature Communications, 2015, 6, 6903
1548513 CIFC22 H30 O5P 19.3123; 11.7835; 11.8236
117.449; 110.752; 94.972
1026.64Cao, Jia-Qing; Tian, Hai-Yan; Li, Man-Mei; Zhang, Wei; Wang, Ying; Wang, Lei; Ye, Wen-Cai
Rearranged Phloroglucinol-Monoterpenoid Adducts from Callistemon rigidus
Journal of Natural Products, 2017
1548563 CIFC34 H43 N O5 S SiP 110.6277; 11.3209; 15.3086
70.82; 77.972; 66.025
1583.5Zhanchao Meng; Haixin Yu; Li Li; Wanyin Tao; Hao Chen; Ming Wan; Peng Yang; David J. Edmonds; Jin Zhong; Ang Li
Total synthesis and antiviral activity of indolosesquiterpenoids from the xiamycin and oridamycin families
Nature Communications, 2015, 6, 6096
1548657 CIFC18 H17 Br N2 O2P 14.681; 6.1091; 14.2048
100.603; 92.652; 94.55
397.25Uno, Brice E.; Dicken, Rachel D.; Redfern, Louis R.; Stern, Charlotte M.; Krzywicki, Greg G.; Scheidt, Karl A.
Calcium(ii)-catalyzed enantioselective conjugate additions of amines.
Chemical science, 2018, 9, 1634-1639
1548693 CIFC22 H42 Br4 Cu2 N6 O2 S2P 17.988; 9.116; 11.625
86.69; 73.837; 80.279
801.3Musabbir A. Saeed; Douglas R. Powell; Md. Alamgir Hossain
Fluorescent detection of phosphate anion by a highly selective chemosensor in water
Tetrahedron Letters, 2010, 51, 4904-4907
1548838 CIFC18 H26 N4 O6 SP 17.4225; 16.5812; 21.1102
82.789; 85.375; 84.403
2559.1Lee, Jisun; Joullié, Madeleine M
Total synthesis of the reported structure of ceanothine D <i>via</i> a novel macrocyclization strategy.
Chemical science, 2018, 9, 2432-2436
1549283 CIFC63 H59 B2 Co F24 I N6 O3 SP 110.4248; 12.9027; 15.4799
101.302; 105.089; 113.446
1735.7Hill, Ethan A.; Kelty, Margaret L.; Filatov, Alexander S.; Anderson, John S.
Isolable iodosylarene and iodoxyarene adducts of Co and their O-atom transfer and C-H activation reactivity.
Chemical science, 2018, 9, 4493-4499
1549395 CIFC47 H36 Dy F9 N2 O6P 110.5005; 10.5156; 11.1246
83.611; 66.854; 74.875
1090.31Li, Xi-Li; Zhu, Cancan; Rong, Qixiang; Wei, Jiahao; Li, Ruixue; Liu, Cai-Ming
A pair of mononuclear Dy(iii) enantiomers showing single-ion magnetic and ferroelectric properties
New Journal of Chemistry, 2018, 42, 10906
1549396 CIFC47 H36 Dy F9 N2 O6P 110.4994; 10.5083; 11.1201
83.608; 66.819; 74.881
1088.75Li, Xi-Li; Zhu, Cancan; Rong, Qixiang; Wei, Jiahao; Li, Ruixue; Liu, Cai-Ming
A pair of mononuclear Dy(iii) enantiomers showing single-ion magnetic and ferroelectric properties
New Journal of Chemistry, 2018, 42, 10906
1549425 CIFC26 H40 N2 O6P 18.8976; 9.7399; 15.4155
93.972; 99.602; 107.215
1248.19Engstrom, Jordan R.; Savyasachi, Aramballi J.; Parhizkar, Marzieh; Sutti, Alessandra; Hawes, Chris S.; White, Jonathan M.; Gunnlaugsson, Thorfinnur; Pfeffer, Frederick M.
Norbornene chaotropic salts as low molecular mass ionic organogelators (LMIOGs).
Chemical science, 2018, 9, 5233-5241
1549588 CIFC17 H16 O2 SeP 16.7562; 7.5182; 8.7692
107.83; 98.976; 113.06
370.28García-López, Diego; Civit, Marc G.; Vogels, Christopher M.; Ricart, Josep M.; Westcott, Stephen A.; Fernández, Elena; Carbó, Jorge J.
Understanding the mechanism of transition metal-free anti addition to alkynes: the selenoboration case
Catalysis Science & Technology, 2018, 8, 3617
1549842 CIFC69 H59 Br2 Co N9 O9 S2P 18.8042; 13.872; 15.012
113.273; 91.702; 108.265
1574.4Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi
Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation.
Chemical science, 2018, 9, 7986-7991
1549843 CIFC69 H59 Br2 Co N9 O9 S2P 18.933; 14.009; 15.07
113.024; 91.175; 108.218
1627Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi
Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation.
Chemical science, 2018, 9, 7986-7991
1549844 CIFC69 H55 Br2 Co N9 O7 S2P 18.7198; 13.8688; 15.15
112.076; 90.143; 106.456
1615.99Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi
Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation.
Chemical science, 2018, 9, 7986-7991
1549845 CIFC69 H55 Br2 Co N9 O7 S2P 18.6715; 13.689; 15.1994
112.725; 90.764; 106.662
1578.49Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi
Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation.
Chemical science, 2018, 9, 7986-7991
1549846 CIFC69 H59 Br2 Co N9 O9 S2P 18.8606; 13.9125; 14.9455
65.422; 87.897; 71.56
1579.8Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi
Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation.
Chemical science, 2018, 9, 7986-7991
1549847 CIFC69 H55 Br2 Co N9 O7 S2P 18.6306; 13.5529; 15.2106
113.16; 91.252; 106.863
1546.66Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi
Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation.
Chemical science, 2018, 9, 7986-7991
1549849 CIFC26 H32 N2 O8 SP 16.25857; 10.36; 11.9013
64.561; 87.812; 84.16
693.22Liu, Yang; Liu, Xiangyuan; Li, Jiangtao; Zhao, Xiaowei; Qiao, Baokun; Jiang, Zhiyong
Catalytic enantioselective radical coupling of activated ketones with <i>N</i>-aryl glycines.
Chemical science, 2018, 9, 8094-8098
1549899 CIF
HKL
Paper
C15 H14 N4 O3P 15.859; 7.479; 16.329
93.818; 91.29; 94.252
711.7Wang, Zhaodong; Ni, Haitao
Methyl 4-{<i>N</i>'-[(1<i>E</i>)-1-(pyrazin-2-yl)ethylidene]hydrazinecarbonyl}benzoate
IUCrData, 2018, 3, x181230
1550004 CIFC67 H10 Al F46 Fe O3P 111.6429; 11.6834; 12.0655
97.981; 101.382; 98.8
1565.64Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens
Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid.
Chemical science, 2018, 9, 8178-8183
1550211 CIFC23 H26 B F2 N O4P 110.235; 10.796; 20.224
92.916; 103.825; 90.9
2166.2Louis, Marine; Sethy, Ramarani; Kumar, Jatish; Katao, Shouhei; Guillot, Régis; Nakashima, Takuya; Allain, Clémence; Kawai, Tsuyoshi; Métivier, Rémi
Mechano-responsive circularly polarized luminescence of organic solid-state chiral emitters
Chemical Science, 2019
1550336 CIF
HKL
Paper
C9 H11 N O3P 14.8011; 6.5522; 7.5052
93.618; 107.044; 95.658
223.575Baillargeon, Pierre; Rahem, Tarik; Amigo, Carl; Fortin, Daniel; Dory, Yves L.
Polar crystal of vanillylformamide through replacement of the alkene by an isosteric formamide group
IUCrData, 2018, 3, x181630
1550423 CIFC60 H46 N8 O7P 19.1177; 10.6349; 13.6347
84.797; 86.884; 73.337
1260.8Gozálvez, Cristian; Zafra, José L.; Saeki, Akinori; Melle-Franco, Manuel; Casado Cordón, Juan; Mateo-Alonso, Aurelio
Charge Transport Modulation in Pseudorotaxane 1D Stacks of Acene and Azaacene Derivatives
Chemical Science, 2019
1550449 CIFC22 H32 N2 O9.5 P SP 18.7929; 12.6645; 23.7867
82.3345; 81.4117; 89.9824
2595.2Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550455 CIFC24 H38 N2 O8P 15.8213; 7.27088; 15.90214
94.7215; 96.6693; 109.525
624.781Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550598 CIFAl2 H4 O9 Si2P 15.17375; 8.98502; 7.35224
91.6843; 105.128; 89.7549
329.789Richard, D.; Rendtorff, N. M.
First principles study of structural properties and electric field gradients in kaolinite
Applied Clay Science, 2019, 169, 67-73
1550837 CIFC32 H40 N4 O2P 110.1957; 12.2494; 23.2226
92.193; 93.573; 106.021
2777.6Qi, Qingkai; Chi, Weijie; Li, Yuanyuan; Qiao, Qinglong; Chen, Jie; Miao, Lu; Zhang, Yi; Li, Jin; Ji, Wei; Xu, Tao; Liu, Xiaogang; Yoon, Juyoung; Xu, Zhaochao
A H-Bond Strategy to Develop Acid-Resistant Photoswitchable Rhodamine Spirolactams for Super-Resolution Single-Molecule Localization Microscopy
Chemical Science, 2019
1550876 CIFC56 H56 Li2 N4 P2P 112.7; 12.756; 43.4
81.58; 88.39; 60.36
6037Feuerstein, Thomas J.; Goswami, Bhupendra; Rauthe, Pascal; Köppe, Ralf; Lebedkin, Sergei; Kappes, Manfred M.; Roesky, Peter W.
Alkali metal complexes of an enantiopure iminophosphonamide ligand with bright delayed fluorescence
Chemical Science, 2019, 10, 4742-4749
1551315 CIFFe4 O5P 18.583; 39.2492; 12.5425
90; 90; 90
4225.3Sergey V. Ovsyannikov; Maxim Bykov; Elena Bykova; Denis P. Kozlenko; Alexander A. Tsirlin; Alexander E. Karkin; Vladimir V. Shchennikov; Sergey E. Kichanov; Huiyang Gou; Artem M. Abakumov; Ricardo Egoavil; Johan Verbeeck; Catherine McCammon; Vadim Dyadkin; Dmitry Chernyshov; Sander van Smaalen; Leonid S. Dubrovinsky
Charge-ordering transition in iron oxide Fe4O5 involving competing dimer and trimer formation
Nature Chemistry, 2016, 8, 501-508
1551345 CIFC312 H313 Cl24 N44 O50P 118.008; 18.419; 30.513
78.68; 88.33; 65.83
9039Soumen De; Bo Chi; Thierry Granier; Ting Qi; Victor Maurizot; Ivan Huc
Designing cooperatively folded abiotic uni- and multimolecular helix bundles
Nature Chemistry, 2018, 10, 51-57
1551346 CIFC112 H104 N18 O21P 125.286; 26.901; 27.418
108.71; 107.77; 109.81
14718Soumen De; Bo Chi; Thierry Granier; Ting Qi; Victor Maurizot; Ivan Huc
Designing cooperatively folded abiotic uni- and multimolecular helix bundles
Nature Chemistry, 2018, 10, 51-57
1551384 CIFC206 H209 N40 O40P 117.018; 19.782; 33.512
81.76; 88.25; 82.41
11067Nagula Chandramouli; Yann Ferrand; Guillaume Lautrette; Brice Kauffmann; Cameron David Mackereth; Michel Laguerre; Didier Dubreuil; Ivan Huc
Iterative design of a helically folded aromatic oligoamide sequence for the selective encapsulation of fructose
Nature Chemistry, 2015, 7, 334-341
1551582 CIFC12 H25 N O13P 16.914; 7.7202; 8.7383
79.467; 73.033; 67.106
409.71FUJIMOTO, Takashi; NISHIO, Toshiyuku; HOSAKA, Hiroki; MIZOGUCHI, Saori; TASHIRO, Mitsuru
Crystal Structure of β-D-Fructofuranosyl-[2↔1]-6-amido-6-deoxy-α-D-glucopyranoside
X-ray Structure Analysis Online, 2017, 33, 63
1551593 CIFC18 H21 Cl3 N3 O2.202 PP 19.6898; 10.4576; 21.0199
83.6336; 89.3963; 73.819
2032.53ARIANI, Maral; POURAYOUBI, Mehrdad; DUŠEK, Michal; VAHDANI ALVIRI, Banafsheh; EIGNER, Václav; DAMODARAN, Krishnan
Synthesis, Spectroscopic Study and Crystal Structure of a New Single-Enantiomer C(O)NHP(O)-based Phosphoric Triamide, CCl<sub>3</sub>C(O)NHP(O)[(R)-(+)-NHCH(CH<sub>3</sub>)(C<sub>6</sub>H<sub>5</sub>)]<sub>2</sub>·0.25H<sub>2</sub>O
X-ray Structure Analysis Online, 2017, 33, 17
1551641 CIFC70 H88 B2 Cu N4 O4P 112.2123; 12.5684; 12.9841
100.526; 107.424; 116.156
1587.4MATSUI, Chihiro; OKAWARA, Toru; NAGAMURA, Toshihiko; TAKEHARA, Kenji
Crystal Structure of Bis(acetone-<i>&kappa;</i><i>O</i>)-1,4,8,11-tetraazacyclotetradecane Copper(II) Ditetraphenylborate Acetone Disolvate
X-ray Structure Analysis Online, 2015, 31, 53
1551889 CIFC29 H31 F14 N O SiP 18.6241; 9.7969; 18.9232
80.469; 83.314; 76.243
1526.55Mattia Silvi; Charlie Verrier; Yannick P. Rey; Luca Buzzetti; Paolo Melchiorre
Visible-light excitation of iminium ions enables the enantioselective catalytic beta-alkylation of enals
Nature Chemistry, 2017, 9, 868-873
1552063 CIFC39 H42 Br N O10P 18.0123; 9.5367; 12.5723
76.698; 83.324; 77.616
910.87Gang Liu; Morgan E. Shirley; Khoi N. Van; Rae Lynn McFarlin; Daniel Romo
Rapid assembly of complex cyclopentanes employing chiral, alpha,beta-unsaturated acylammonium intermediates
Nature Chemistry, 2013, 5, 1049-1057
1552277 CIFC26 H52 N6 O2 Pt S4P 16.189; 12.221; 12.196
86.03; 75.35; 79.55
877.396Bisceglie, Franco; Orsoni, Nicolò; Pioli, Marianna; Bonati, Beatrice; Tarasconi, Pieralberto; Rivetti, Claudio; Amidani, Davide; Montalbano, Serena; Buschini, Annamaria; Pelosi, Giorgio
Cytotoxic activity of copper(ii), nickel(ii) and platinum(ii) thiosemicarbazone derivatives: interaction with DNA and the H2A histone peptide.
Metallomics : integrated biometal science, 2019, 11, 1729-1742
1552374 CIFC16 Al F36 O4 TlP 19.6336; 10.4764; 16.8374
81.433; 73.486; 63.371
1455.95Weis, Philippe; Röhner, David C.; Prediger, Richard; Butschke, Burkhard; Scherer, Harald; Weber, Stefan; Krossing, Ingo
First Experimental Evidence for the Elusive Tetrahedral Cations [EP3]+ in the Condensed Phase
Chemical Science, 2019
1552489 CIFC26 H30 F3 N7 O9P 15.0591; 10.9615; 13.2
103.037; 90.846; 90.3108
713.03Policarpo, Rocco L.; Decultot, Ludovic; May, Elizabeth; Kuzmič, Petr; Carlson, Samuel; Huang, Danny; Chu, Vincent; Wright, Brandon A.; Dhakshinamoorthy, Saravanakumar; Kannt, Aimo; Rani, Shilpa; Dittakavi, Sreekanth; Panarese, Joseph D.; Gaudet, Rachelle; Shair, Matthew D.
High-Affinity Alkynyl Bisubstrate Inhibitors of Nicotinamide <i>N</i>-Methyltransferase (NNMT).
Journal of medicinal chemistry, 2019
1552492 CIFC28.5 H33 F3 N O6.5P 18.9167; 11.8688; 14.75
68.987; 73.43; 77.232
1384.3Tshitenge, Dieudonné Tshitenge; Bruhn, Torsten; Feineis, Doris; Schmidt, David; Mudogo, Virima; Kaiser, Marcel; Brun, Reto; Würthner, Frank; Awale, Suresh; Bringmann, Gerhard
Ealamines A-H, a Series of Naphthylisoquinolines with the Rare 7,8'-Coupling Site, from the Congolese Liana <i>Ancistrocladus ealaensis</i>, Targeting Pancreatic Cancer Cells.
Journal of natural products, 2019
1552558 CIFC27 H29 N5 O3P 18.6537; 8.8678; 16.7811
77.756; 82.545; 68.655
1170.2Guo, Yunhang; Liu, Ye; Hu, Nan; Yu, Desheng; Zhou, Changyou; Shi, Gongyin; Zhang, Bo; Wei, Min; Liu, Junhua; Luo, Lusong; Tang, Zhiyu; Song, Huipeng; Guo, Yin; Liu, Xuesong; Su, Dan; Zhang, Shuo; Song, Xiaomin; Zhou, Xing; Hong, Yuan; Chen, Shuaishuai; Cheng, Zhenzhen; Young, Steve; Wei, Qiang; Wang, Haisheng; Wang, Qiuwen; Lv, Lei; Wang, Fan; Xu, Haipeng; Sun, Hanzi; Xing, Haimei; Li, Na; Zhang, Wei; Wang, Zhongbo; Liu, Guodong; Sun, Zhijian; Zhou, Dongping; Li, Wei; Liu, Libin; Wang, Lai; Wang, Zhiwei
Discovery of Zanubrutinib (BGB-3111), a Novel, Potent, and Selective Covalent Inhibitor of Bruton's Tyrosine Kinase.
Journal of medicinal chemistry, 2019, 62, 7923-7940
1552571 CIFC36 H55 N O4P 17.3195; 16.8609; 21.8814
69.35; 87.717; 83.935
2512.8Wei, Wen-Jun; Song, Qiu-Yan; Ying, Jin-Chuan; Li, Hang-Ying; Ma, Kai-Liang; Li, Yida; Li, Ya; Gao, Kun
Highly Oxygenated Triterpenoids and Rare Tetraterpenoids from <i>Abies chensiensis</i> and Their Antibacterial Activity.
Journal of natural products, 2019, 82, 2859-2869
1552585 CIFC29.75 H38.75 O7.75P 19.3591; 12.5274; 12.547
74.614; 88.037; 88.948
1417.45Su, Jun-Cheng; Cheng, Wen; Song, Jian-Guo; Zhong, Yuan-Lin; Huang, Xiao-Jun; Jiang, Ren-Wang; Li, Yao-Lan; Li, Man-Mei; Ye, Wen-Cai; Wang, Ying
Macrocyclic Diterpenoids from <i>Euphorbia helioscopia</i> and Their Potential Anti-inflammatory Activity.
Journal of natural products, 2019, 82, 2818-2827
1552597 CIFC32 H38 O10P 17.43158; 12.64114; 16.6155
68.6576; 84.8142; 83.4169
1442.29Solipeta, Divya Reddy; Bandi, Siva; Vemulapalli, Sahithya Phani Babu; Pallavi, Preethi M. C.; Vemireddy, Sravanthi; Balasubramania, Sridhar; Mahabalarao, Sampath Kumar H.; Katragadda, Suresh Babu
Secophragmalin-Type Limonoids from <i>Trichilia connaroides</i>: Isolation, Semisynthesis, and Their Cytotoxic Activities.
Journal of natural products, 2019, 82, 2731-2743
1552682 CIFC19 H20 N2P 16.5325; 7.8576; 8.6225
109.428; 94.781; 113.321
371.29Wong, Soon-Kit; Wong, Suet-Pick; Sim, Kae-Shin; Lim, Siew-Huah; Low, Yun-Yee; Kam, Toh-Seok
A Cytotoxic Indole Characterized by Incorporation of a Unique Carbon-Nitrogen Skeleton and Two Pentacyclic Corynanthean Alkaloids Incorporating a Substituted Tetrahydrofuranone Ring from <i>Kopsia arborea</i>.
Journal of natural products, 2019, 82, 1902-1907
1552705 CIFC31 H51 N O2P 16.4002; 7.3244; 15.8163
76.713; 85.687; 65.123
654.44Kazakova, Oxana B.; Khusnutdinova, Elmira F.; Petrova, Anastasiya V.; Yamansarov, Emil Yu; Lobov, Alexander N.; Fedorova, Alexandra A.; Suponitsky, Kyrill Yu
Diastereoselective Synthesis of Triterpenoid 1,2,4-Trioxolanes by Griesbaum Co-ozonolysis.
Journal of natural products, 2019, 82, 2550-2558
1552712 CIFC20 H20 O5P 17.3973; 11.0738; 12.082
69.81; 77.629; 77.212
895.52Paguigan, Noemi D.; Rivera-Chávez, José; Stempin, Justin J.; Augustinović, Mario; Noras, Aleksandra I.; Raja, Huzefa A.; Todd, Daniel A.; Triplett, Kathleen D.; Day, Cynthia; Figueroa, Mario; Hall, Pamela R.; Cech, Nadja B.; Oberlies, Nicholas H.
Prenylated Diresorcinols Inhibit Bacterial Quorum Sensing.
Journal of natural products, 2019, 82, 550-558
1552944 CIFC30 H45 N4 O2P 16.0631; 9.7279; 11.3631
89.483; 87.316; 77.462
653.51Fan, Chun-Lin; Zhang, Yu-Bo; Chen, Ye; Xie, Pei; Wang, Guo-Cai; Tian, Hai-Yan; Li, Yao-Lan; Huang, Xiao-Jun; Zhang, Xiao-Qi; Li, Zhi-Yong; Liu, Jun-Shan; Ye, Wen-Cai; Chen, Wei-Min
Alopecuroides A‒E, Matrine-Type Alkaloid Dimers from the Aerial Parts of Sophora alopecuroides
Journal of Natural Products, 2019
1552945 CIFC31 H48 N4 O3P 18.4347; 8.6934; 9.8006
101.982; 95.217; 96.552
693.518Fan, Chun-Lin; Zhang, Yu-Bo; Chen, Ye; Xie, Pei; Wang, Guo-Cai; Tian, Hai-Yan; Li, Yao-Lan; Huang, Xiao-Jun; Zhang, Xiao-Qi; Li, Zhi-Yong; Liu, Jun-Shan; Ye, Wen-Cai; Chen, Wei-Min
Alopecuroides A‒E, Matrine-Type Alkaloid Dimers from the Aerial Parts of Sophora alopecuroides
Journal of Natural Products, 2019
1552972 CIFC17 H21 B Br O PP 16.4951; 9.549; 15.501
81.333; 86.707; 74.351
915Li, Chun; Bian, Qing-Long; Xu, Sheng; Duan, Wei-Liang
Palladium-catalyzed 1,4-addition of secondary alkylphenylphosphines to α,β-unsaturated carbonyl compounds for the synthesis of phosphorus- and carbon-stereogenic compounds
Org. Chem. Front., 2014, 1, 541
1553294 CIFC45 H63 N O7P 16.3429; 7.2295; 22.835
86.897; 87.866; 68.166
970.42Li, Jin-Long; Wu, Lei; Wu, Jian; Feng, Hong-Xuan; Wang, Hong-Min; Fu, Yan; Zhang, Ru-Jun; Zhang, Hai-Yan; Zhao, Wei-Min
Caffeoyl Triterpenoid Esters as Potential Anti-ischemic Stroke Agents from Celastrus orbiculatus.
Journal of natural products, 2016, 79, 2774-2779
1553299 CIFC14 H22 O6P 16.3082; 7.5108; 8.11
88.911; 85.044; 77.888
374.29Liu, Shuai; Dai, Haofu; Makhloufi, Gamall; Heering, Christian; Janiak, Christoph; Hartmann, Rudolf; Mándi, Attila; Kurtán, Tibor; Müller, Werner E G; Kassack, Matthias U.; Lin, Wenhan; Liu, Zhen; Proksch, Peter
Cytotoxic 14-Membered Macrolides from a Mangrove-Derived Endophytic Fungus, Pestalotiopsis microspora.
Journal of natural products, 2016, 79, 2332-2340
1553335 CIFC13 H15 Cl O7P 15.0238; 5.5679; 12.8812
99.395; 94.679; 105.645
339.31Cai, Runlin; Wu, Yingnan; Chen, Senhua; Cui, Hui; Liu, Zhaoming; Li, Chunyuan; She, Zhigang
Peniisocoumarins A-J: Isocoumarins from Penicillium commune QQF-3, an Endophytic Fungus of the Mangrove Plant Kandelia candel.
Journal of natural products, 2018, 81, 1376-1383
1553342 CIFC17 H22 O9P 14.9; 12.5; 14.55
86.4; 88.07; 80.31
876.5Deans, Bianca J.; Kilah, Nathan L.; Jordan, Gregory J.; Bissember, Alex C.; Smith, Jason A.
Arbutin Derivatives Isolated from Ancient Proteaceae: Potential Phytochemical Markers Present in Bellendena, Cenarrhenes, and Persoonia Genera.
Journal of natural products, 2018, 81, 1241-1251
1553348 CIFC26 H34 O8P 16.5706; 7.0972; 13.8873
103.479; 90.068; 105.91
604.17Qi, Changxing; Liu, Mengting; Zhou, Qun; Gao, Weixi; Chen, Chunmei; Lai, Yongji; Hu, Zhengxi; Xue, Yongbo; Zhang, Jinwen; Li, Dongyan; Li, Xiao-Nian; Zhang, Qing; Wang, Jianping; Zhu, Hucheng; Zhang, Yonghui
BACE1 Inhibitory Meroterpenoids from Aspergillus terreus.
Journal of natural products, 2018, 81, 1937-1945
1553360 CIFC24 H39 N O7P 18.054; 12.548; 14.0945
115.86; 94.702; 102.435
1226.37Wang, Wenjing; Gong, Jiaojiao; Liu, Xiaorui; Dai, Chong; Wang, Yanyan; Li, Xiao-Nian; Wang, Jianping; Luo, Zengwei; Zhou, Yuan; Xue, Yongbo; Zhu, Hucheng; Chen, Chunmei; Zhang, Yonghui
Cytochalasans Produced by the Coculture of Aspergillus flavipes and Chaetomium globosum.
Journal of natural products, 2018, 81, 1578-1587
1553376 CIFC21 H32 O3P 16.2785; 10.5538; 14.393
100.197; 100.924; 91.722
919.64Zhang, Shasha; Wang, Xia; Hao, Jin; Li, Dangdang; Csuk, René; Li, Shengkun
Expediently Scalable Synthesis and Antifungal Exploration of (+)-Yahazunol and Related Meroterpenoids.
Journal of natural products, 2018, 81, 2010-2017
1553750 CIFC26 H31 N3 O6P 19.0047; 9.2247; 9.4826
109.875; 108.593; 107.103
626.45Guo, Jing; Lin, Zi-Hui; Chen, Kai-Bin; Xie, Ying; Chan, Albert S. C.; Weng, Jiang; Lu, Gui
Asymmetric amination of 2-substituted indolin-3-ones catalyzed by natural cinchona alkaloids
Organic Chemistry Frontiers, 2017, 4, 1400
1553817 CIFC20 H16 F3 N O3 SP 18.5679; 12.3701; 18.181
83.843; 89.595; 80.871
1891.4De Nisi, A.; Sierra, S.; Ferrara, M.; Monari, M.; Bandini, M.
TBAF catalyzed one-pot synthesis of allenyl-indoles
Organic Chemistry Frontiers, 2017, 4, 1849
1553852 CIFC88 H122 N2 O4 S2P 18.9041; 14.0916; 16.2768
104.121; 91.824; 94.954
1970.23Zhang, Yuehong; Wang, Chiming; Chen, Xin; Pan, Houhe; Qi, Dongdong; Wang, Kang; Jiang, Jianzhuang
Novel, linear oligoisoindole compounds with a conjugated electronic structure
Organic Chemistry Frontiers, 2017, 4, 2364
1553941 CIFC23 H22 N2 O7P 19.297; 11.515; 11.957
61.974; 80.333; 67.602
1044.6Han, Jianxin; Niu, Sheng-Tong; Liu, Yushuang; Gan, Lishe; Wang, Tianfu; Lu, Chong-Dao; Yuan, Tao
Robustanoids A and B, two novel pyrrolo[2,3-b]indole alkaloids from Coffea canephora: isolation and total synthesis
Organic Chemistry Frontiers, 2018, 5, 586
1554165 CIFC37 H48 N O PP 110.369; 10.511; 16.499
94.563; 96.525; 114.894
1604.3Serin, Spencer C.; Dake, Gregory R.; Gates, Derek P.
Addition-Isomerization Polymerization of Chiral Phosphaalkenes: Observation of Styrene‒Phosphaalkene Linkages in a Random Copolymer
Macromolecules, 2016, 49, 4067
1554236 CIFC25 H20 SP 18.886; 10.971; 11.261
64.477; 78.704; 77.452
960.5Wang, Can; Yu, Yun; Chai, Zhaofei; He, Fangdi; Wu, Chaozheng; Gong, Yanbin; Han, Mengmeng; Li, Qianqian; Li, Zhen
Recyclable mechanoluminescent luminogen: different polymorphs, different self-assembly effects of the thiophene moiety and recovered molecular packing via simple thermal-treatment
Materials Chemistry Frontiers, 2019, 3, 32
1554254 CIFC28 H36 O8P 113.986; 14.019; 28.0285
98.119; 91.053; 90.157
5439.5Yin, Guo-Ping; Wu, Ya-Rong; Han, Chao; Wang, Xiao-Bing; Gao, Hong-Liang; Yin, Yong; Kong, Ling-Yi; Yang, Ming-Hua
Asperones A‒E, five dimeric polyketides with new carbon skeletons from the fungus Aspergillus sp. AWG 1‒15
Organic Chemistry Frontiers, 2018, 5, 2432
1554273 CIFC77.37 H93.1 N4 O24P 110.54064; 14.6009; 14.9312
62.0192; 84.9082; 68.8864
1884.1Li, Wan-Shan; Yang, Yang; Liu, Jun-Jun; Shen, Li; Shi, Zhi; Wu, Jun
Scaffold diversity-oriented synthesis of limonoid dimers: discovery of an axially chiral agent within vivoanti-breast cancer activity
Organic Chemistry Frontiers, 2018, 5, 1079
1554324 CIFC31 H56 F6 Mg N4 O14 S2P 19.2007; 9.2791; 14.237
97.598; 91.193; 97.349
1194.02Zhang, Xiying; Liu, Xiaohua; Zhang, Jianlin; Zhang, Dong; Lin, Lili; Feng, Xiaoming
Enantioselective [3 + 2] cycloaddition and rearrangement of thiazolium salts to synthesize thiazole and 1,4-thiazine derivatives
Organic Chemistry Frontiers, 2018, 5, 2126
1554425 CIFC18 H16 Br F O2P 16.6841; 8.7074; 14.4482
87.391; 81.591; 78.532
815.14Cao, Zhong-Yan; Wang, Wenmin; Liao, Kui; Wang, Xiaoming; Zhou, Jian; Ma, Jing
Catalytic enantioselective synthesis of cyclopropanes featuring vicinal all-carbon quaternary stereocenters with a CH2F group; study of the influence of C‒F⋯H‒N interactions on reactivity
Organic Chemistry Frontiers, 2018, 5, 2960
1554500 CIFC27 H22 N O2 PP 16.0253; 9.0011; 10.3679
75.005; 76.437; 89.09
527.4Zhang, Dong-Liang; Li, Cheng-Kun; Zeng, Run-Sheng; Shoberu, Adedamola; Zou, Jian-Ping
Manganese(iii)-mediated selective phosphorylation of enamides: direct synthesis of β-phosphoryl enamides
Organic Chemistry Frontiers, 2019, 6, 236
1554573 CIFC10 H13 N O3P 16.9308; 6.9507; 11.8464
84.194; 79.023; 64.094
503.84Yang, Wu-Lin; Sun, Zhong-Tao; Zhang, Jian; Li, Zhong; Deng, Wei-Ping
Enantioselective synthesis of 3-amino-hydrobenzofuran-2,5-diones via Cu(i)-catalyzed intramolecular conjugate addition of imino esters
Organic Chemistry Frontiers, 2019, 6, 579
1554676 CIFC30 H22 N2 O2 SP 112.1382; 12.8179; 15.1854
85.684; 78.373; 89.276
2307.59Chen, Yitong; Xu, Chao; Xu, Bingjia; Mao, Zhu; Li, Jian-An; Yang, Zhan; Peethani, Naga Raju; Liu, Cong; Shi, Guang; Gu, Feng Long; Zhang, Yi; Chi, Zhenguo
Chirality-activated mechanoluminescence from aggregation-induced emission enantiomers with high contrast mechanochromism and force-induced delayed fluorescence
Materials Chemistry Frontiers, 2019, 3, 1800
1554678 CIFC30 H22 N2 O2 SP 112.135; 12.8327; 15.1864
85.785; 78.371; 89.345
2310.08Chen, Yitong; Xu, Chao; Xu, Bingjia; Mao, Zhu; Li, Jian-An; Yang, Zhan; Peethani, Naga Raju; Liu, Cong; Shi, Guang; Gu, Feng Long; Zhang, Yi; Chi, Zhenguo
Chirality-activated mechanoluminescence from aggregation-induced emission enantiomers with high contrast mechanochromism and force-induced delayed fluorescence
Materials Chemistry Frontiers, 2019, 3, 1800
1554735 CIFC32 H33 Cl3 N4 Ni O4P 19.3743; 13.379; 14.9327
81.008; 89.658; 80.276
1822.85Larionov, Vladimir A.; Stoletova, Nadezhda V.; Kovalev, Vladislav I.; Smol'yakov, Alexander F.; Savel'yeva, Tat'yana F.; Maleev, Victor I.
A general synthesis of unnatural α-amino acids by iron-catalysed olefin‒olefin coupling via generated radicals
Organic Chemistry Frontiers, 2019, 6, 1094
1554885 CIFC20 H20 Br2 Cl2 N2 O4P 15.0746; 14.828; 16.699
65.191; 89.579; 80.838
1123.5Shemet, Andrej; Sarlah, David; Carreira, Erick M.
Stereochemical studies of the opening of chloro vinyl epoxides: cyclic chloronium ions as intermediates.
Organic letters, 2015, 17, 1878-1881
1555006 CIFC30 H35 N O4P 19.7073; 10.168; 14.0374
85.597; 85.998; 82.306
1366.53Davies, Stephen G.; Fletcher, Ai M.; Frost, Aileen B.; Roberts, Paul M.; Thomson, James E.
Asymmetric Synthesis of Substituted anti-β-Fluorophenylalanines.
Organic letters, 2015, 17, 2254-2257
1555007 CIFC28 H31 F2 N O2P 110.4764; 10.6867; 12.3768
85.757; 70.552; 69.477
1222.26Davies, Stephen G.; Fletcher, Ai M.; Frost, Aileen B.; Roberts, Paul M.; Thomson, James E.
Asymmetric Synthesis of Substituted anti-β-Fluorophenylalanines.
Organic letters, 2015, 17, 2254-2257
1555042 CIFC33 H38 N O5P 19.1302; 9.1578; 10.226
108.986; 98.417; 114.037
698.83Freeman, Jared L.; Brimble, Margaret A.; Furkert, Daniel P.
A chiral auxiliary-based synthesis of the C5‒C17 trans-decalin framework of anthracimycin
Organic Chemistry Frontiers, 2019, 6, 2954
1555113 CIFC33 H25 Cl N2 O5P 110.596; 11.6796; 12.6988
69.855; 70.549; 88.791
1383.42Wang, Zhen-Hua; Lei, Chuan-Wen; Zhang, Xia-Yan; You, Yong; Zhao, Jian-Qiang; Yuan, Wei-Cheng
Asymmetric domino 1,6-addition/annulation reaction of 3-cyano-4-alkenyl-2H-chromen-2-ones with isatin-derived MBH carbonates: enantioselective synthesis of 3,3′-cyclopentenylspirooxindoles bearing 2H-chromen-2-ones
Organic Chemistry Frontiers, 2019, 6, 3342
1555114 CIFC18 H23 N O5 SP 18.6291; 9.4332; 12.4474
82.659; 70.506; 68.236
887.04Hsueh, Nathanael; Clarkson, Guy J.; Shipman, Michael
Generation and Ring Opening of Aziridines in Telescoped Continuous Flow Processes.
Organic letters, 2015, 17, 3632-3635
1555129 CIFC7.5 H15 O2P 17.0302; 7.6119; 7.7844
94.191; 109.731; 97.56
385.61Song, Yin-Ping; Miao, Feng-Ping; Yin, Xiu-Li; Ji, Nai-Yun
Nitrogenous cyclonerane sesquiterpenes from an algicolous strain of Trichoderma asperellum
Organic Chemistry Frontiers, 2019, 6, 3698
1555277 CIFC32.33333 H57.66667 N6 O12.66667P 115.4725; 16.0538; 16.749
107.8; 106.461; 106.157
3482.3Ganesh Kumar, Mothukuri; Gopi, Hosahudya N.
γ- and β-Peptide Foldamers from Common Multifaceted Building Blocks: Synthesis and Structural Characterization.
Organic letters, 2015, 17, 4738-4741
1555328 CIFC35 H30 Br F N4 O4P 18.4125; 9.7659; 11.5692
108.577; 95.876; 110.228
820.9Bao, Xiaoze; Wang, Baomin; Cui, Longchen; Zhu, Guodong; He, Yuli; Qu, Jingping; Song, Yuming
An Organocatalytic Asymmetric Friedel-Crafts Addition/Fluorination Sequence: Construction of Oxindole-Pyrazolone Conjugates Bearing Vicinal Tetrasubstituted Stereocenters.
Organic letters, 2015, 17, 5168-5171
1555545 CIFC24 H25 N O4P 112.7971; 12.8656; 14.0933
88.968; 86.108; 66.582
2124.21Ruchti, Jonathan; Carreira, Erick M.
Rh-Catalyzed Stereospecific Synthesis of Allenes from Propargylic Benzoates and Arylboronic Acids.
Organic letters, 2016, 18, 2174-2176
1555571 CIFC24 H35 N O5P 15.9846; 7.913; 12.691
99.814; 95.953; 107.509
557Nagaraju, Karre; Chegondi, Rambabu; Chandrasekhar, Srivari
Expanding Diversity without Protecting Groups: (+)-Sclareolide to Indolosesquiterpene Alkaloid Mycoleptodiscin A and Analogues.
Organic letters, 2016, 18, 2684-2687
1555592 CIFC66 H66 O12 P2P 111.2057; 15.2204; 18.506
71.165; 81.596; 89.993
2951.5Durantie, Estelle; Huwiler, Samuel; Leroux, Jean-Christophe; Castagner, Bastien
A Chiral Phosphoramidite Reagent for the Synthesis of Inositol Phosphates.
Organic letters, 2016, 18, 3162-3165
1555681 CIFC27.5 H23.5 Br Cl1.5 N2 O8P 19.4486; 11.0765; 16.057
73.497; 87.912; 72.63
1535.63Bender, Trandon A.; Dabrowski, Jennifer A.; Zhong, Hongyu; Gagné, Michel R
Diastereoselective B(C6F5)3-Catalyzed Reductive Carbocyclization of Unsaturated Carbohydrates.
Organic letters, 2016, 18, 4120-4123
1555793 CIFC30 H22 Br2 N2 O4 S2P 17.9207; 9.0758; 11.1924
80.79; 71.85; 65.087
693.02Seo, Boram; Kim, Ya Gob; Lee, Phil Ho
Synthesis of Isothiazole via the Rhodium-Catalyzed Transannulation of 1,2,3-Thiadiazoles with Nitriles.
Organic letters, 2016, 18, 5050-5053
1555826 CIFC18 H14 O3P 17.6607; 9.2315; 11.127
72.019; 79.887; 74.428
717.29Zhu, Gongming; Bao, Guangjun; Li, Yiping; Yang, Junxian; Sun, Wangsheng; Li, Jing; Hong, Liang; Wang, Rui
Chiral Phosphoric Acid Catalyzed Asymmetric Oxidative Dearomatization of Naphthols with Quinones.
Organic letters, 2016, 18, 5288-5291
1555870 CIFC20 H21 N O2P 17.0663; 8.3624; 8.9048
115.442; 109.848; 92.591
435.48Guo, Jing; Lin, Lili; Liu, Yangbin; Li, Xiangqiang; Liu, Xiaohua; Feng, Xiaoming
Nickel(II)-Catalyzed Enantioselective α-Vinylation of β-Keto Amides/Esters with Hypervalent Iodine Salts.
Organic letters, 2016, 18, 5540-5543
1556027 CIFC51 H37 N5 O S ZnP 110.6689; 10.8762; 18.2817
83.457; 84.152; 77.519
2051.2Gholami, Hadi; Zhang, Jun; Anyika, Mercy; Borhan, Babak
Absolute Stereochemical Determination of Asymmetric Sulfoxides via Central to Axial Induction of Chirality.
Organic letters, 2017, 19, 1722-1725
1556114 CIFC18 H20 Cl N OP 19.0186; 10.1685; 10.338
106.26; 92.413; 114.734
812.73Tanaka, Ken; Wada, Azusa; Noguchi, Keiichi
Rhodium-catalyzed chemo-, regio-, and enantioselective [2 + 2 + 2] cycloaddition of alkynes with isocyanates.
Organic letters, 2005, 7, 4737-4739
1556140 CIFC22 H21 Cl O4P 15.7264; 7.5889; 21.5174
91.997; 94.434; 90.306
931.69Bastida, David; Liu, Yankai; Tian, Xu; Escudero-Adán, Eduardo; Melchiorre, Paolo
Asymmetric vinylogous aldol reaction via H-bond-directing dienamine catalysis.
Organic letters, 2013, 15, 220-223
1556221 CIFC32 H37 Br O5P 15.9898; 9.7098; 12.2465
90.307; 91.544; 99.152
702.9Ma, Shuang-Gang; Gao, Rong-Mei; Li, Yu-Huan; Jiang, Jian-Dong; Gong, Ning-Bo; Li, Li; Lü, Yang; Tang, Wen-Zhao; Liu, Yun-Bao; Qu, Jing; Lü, Hai-Ning; Li, Yong; Yu, Shi-Shan
Antiviral spirooliganones A and B with unprecedented skeletons from the roots of Illicium oligandrum.
Organic letters, 2013, 15, 4450-4453
1556228 CIFC24 H31 N O3 S2P 18.2523; 9.66; 15.0901
79.648; 84.413; 82.507
1169.88Fernández de la Pradilla, Roberto; Simal, Carmen; Bates, Robert H.; Viso, Alma; Infantes, Lourdes
Sulfoxide-directed enantioselective synthesis of functionalized tetrahydropyridines.
Organic letters, 2013, 15, 4936-4939
1556327 CIFC30 H56 Cl2 N4 O2 PdP 18.1693; 9.1162; 22.9935
93.592; 91.806; 89.939
1708.2Peral, Daniel; Gómez-Villarraga, Fernando; Sala, Xavier; Pons, Josefina; Carles Bayón, J.; Ros, Josep; Guerrero, Miguel; Vendier, Laure; Lecante, Pierre; García-Antón, Jordi; Philippot, Karine
Palladium catalytic systems with hybrid pyrazole ligands in C‒C coupling reactions. Nanoparticles versus molecular complexes
Catal. Sci. Technol., 2013, 3, 475
1556334 CIFC85 H86 B Cl4 F4 O6 P6 Rh3P 113.136; 13.405; 14.779
85.58; 68.44; 68.06
2239.6Preetz, Angelika; Kohrt, Christina; Meißner, Antje; Wei, Siping; Drexler, Hans-Joachim; Buschmann, Helmut; Heller, Detlef
Halide bridged trinuclear rhodium complexes and their inhibiting influence on catalysis
Catal. Sci. Technol., 2013, 3, 462
1556339 CIFC36 H86 B F4 O2 P6 Rh3P 112.416; 12.444; 18.186
95.81; 94.37; 111.98
2572.3Preetz, Angelika; Kohrt, Christina; Meißner, Antje; Wei, Siping; Drexler, Hans-Joachim; Buschmann, Helmut; Heller, Detlef
Halide bridged trinuclear rhodium complexes and their inhibiting influence on catalysis
Catal. Sci. Technol., 2013, 3, 462
1556340 CIFC37 H86 B Cl4 F4 P6 Rh3P 19.6676; 12.005; 12.658
109.83; 94.19; 90.56
1377.3Preetz, Angelika; Kohrt, Christina; Meißner, Antje; Wei, Siping; Drexler, Hans-Joachim; Buschmann, Helmut; Heller, Detlef
Halide bridged trinuclear rhodium complexes and their inhibiting influence on catalysis
Catal. Sci. Technol., 2013, 3, 462
1556871 CIFC59 H27 F20 Fe N5P 110.5317; 14.347; 17.434
76.71; 80.147; 84.826
2522.3Wang, Hai-Xu; Wan, Qingyun; Low, Kam-Hung; Zhou, Cong-Ying; Huang, Jie-Sheng; Zhang, Jun-Long; Che, Chi-Ming
Stable group 8 metal porphyrin mono- and bis(dialkylcarbene) complexes: synthesis, characterization, and catalytic activity.
Chemical science, 2020, 11, 2243-2259
1557030 CIFC50 H22 Al2 F74 Mg N6 O8P 114.3953; 18.2606; 25.8315
73.784; 74.37; 66.821
5895.1Schorpp, Marcel; Krossing, Ingo
Soft interactions with hard Lewis acids: generation of mono- and dicationic alkaline-earth metal arene-complexes by direct oxidation.
Chemical science, 2020, 11, 2068-2076
1557185 CIFC25 H23 F4 N5 O5P 110.1492; 10.1392; 25.2626
96.515; 96.515; 107.35
2435.42Yang, Yaxi; Zhang, Rukang; Li, Zhaojun; Mei, Lianghe; Wan, Shili; Ding, Hong; Chen, Zhifeng; Xing, Jing; Feng, Huijin; Han, Jie; Jiang, Hualiang; Zheng, Mingyue; Luo, Cheng; Zhou, Bing
Discovery of Highly Potent, Selective, and Orally Efficacious p300/CBP Histone Acetyltransferases Inhibitors.
Journal of medicinal chemistry, 2020
1557202 CIFC21 H26 O5P 16.3062; 7.6848; 9.7183
87.904; 80.198; 87.694
463.505Wang, Rong; Fan, Run-Zhu; Ni, Fu-Qiang; Sang, Jun; Xie, Xing-Lin; Luo, Si-Yuan; Tang, Gui-Hua; Yin, Sheng
19-nor-, 20-nor-, and tetranor-Halimane-Type Furanoditerpenoids from Croton crassifolius
Journal of Natural Products, 2020
1557260 CIFCr H9 N12P 17.661; 10.19; 5.807
93.58; 101.37; 81.3
439.1Dossing, Anders; Engberg, Pernille; Hazell, Rita
Crystal Structures and Nitrosation Reactions of Triamminetriazido Complexes of Chromium(III)
Acta Chemica Scandinavica, 1997, 51, 849-854
1557272 CIFC35 H40 O12P 18.505; 9.1711; 10.7701
100.159; 99.818; 90.932
813.86Fu, Yifan; Zhao, Weimin
Polyesterified Sesquiterpenoids from the Seeds of <i>Celastrus paniculatus</i> as Lifespan-Extending Agents for the Nematode <i>Caenorhabditis elegans</i>.
Journal of natural products, 2020, 83, 505-515
1557332 CIFC112.95 H130.95 Cl15.56 O28P 114.334; 15.534; 16.891
69.752; 70.947; 76.995
3308.6Payne, Daniel T.; Webre, Whitney A.; Gobeze, Habtom B.; Seetharaman, Sairaman; Matsushita, Yoshitaka; Karr, Paul A.; Chahal, Mandeep K.; Labuta, Jan; Jevasuwan, Wipakorn; Fukata, Naoki; Fossey, John S.; Ariga, Katsuhiko; D'Souza, Francis; Hill, Jonathan P.
Nanomolecular singlet oxygen photosensitizers based on hemiquinonoid-resorcinarenes, the fuchsonarenes.
Chemical science, 2020, 11, 2614-2620
1557371 CIFC27 H19 N O3P 17.1378; 9.8466; 14.7942
88.9786; 79.0044; 74.6213
983.56Sasaki, Yui; Kojima, Soya; Hamedpour, Vahid; Kubota, Riku; Takizawa, Shin-ya; Yoshikawa, Isao; Houjou, Hirohiko; Kubo, Yuji; Minami, Tsuyoshi
Accurate chiral pattern recognition for amines from just a single chemosensor
Chemical Science, 2020, 11, 3790-3796
1557467 CIFC61 H79 Cl N2 PdP 110.9521; 12.1033; 12.578
115.914; 92.683; 110.251
1367.6Dai, Shengyu; Li, Shuaikang; Xu, Guoyong; Wu, Cheng; Liao, Yudan; Guo, Lihua
Flexible cycloalkyl substituents in insertion polymerization with α-diimine nickel and palladium species
Polymer Chemistry, 2020, 11, 1393-1400
1557726 CIFC10 H17 Cl4 N2 O Ru S3P 18.0381; 8.1691; 8.3951
85.2736; 71.5044; 61.7748
459.11Huffman, Samantha E.; Yawson, Gideon K.; Fisher, Samuel S.; Bothwell, Paige J.; Platt, David C.; Jones, Marjorie A.; Hamaker, Christopher G.; Webb, Michael I.
Ruthenium(iii) complexes containing thiazole-based ligands that modulate amyloid-β aggregation.
Metallomics : integrated biometal science, 2020, 12, 491-503
1557888 CIFC16 H19 Cl O6P 18.6811; 9.5462; 10.951
69.576; 84.021; 68.822
792.79Zhou, Jia; Gao, Ying; Chang, Jin-Ling; Yu, Heng-Yi; Chen, Juan; Zhou, Ming; Meng, Xiang-Gao; Ruan, Han-Li
Resorcylic Acid Lactones from an Ilyonectria sp.
Journal of Natural Products, 2020
1558175 CIFC19 H23 N3 O2P 16.0571; 10.1647; 14.3715
103.628; 98.272; 101.112
827.01Pagire, Santosh K.; Kumagai, Naoya; Shibasaki, Masakatsu
Introduction of a 7-aza-6-MeO-indoline auxiliary in Lewis-acid/photoredox cooperative catalysis: highly enantioselective aminomethylation of α,β-unsaturated amides
Chemical Science, 2020, 11, 5168-5174
1558329 CIF
HKL
Paper
C23 H34 Cl3 N O12P 15.5734; 9.2537; 14.2547
91.995; 99.103; 95.567
721.56Amaro Hernández, Aldo Guillermo; Rodríguez Tzompantzi, Tomasa; Dávila García, Álvaro; Meza-León, Rosa Luisa; Bernès, Sylvain
Ethyl (3<i>S</i>)-3-[(3a<i>R</i>,5<i>R</i>,6<i>S</i>,6a<i>R</i>)-6-hydroxy-2,2-dimethyltetrahydrofuro[4,5-<i>d</i>][1,3]dioxol-5-yl]-3-{(3<i>S</i>)-3-[(3a<i>R</i>,5<i>R</i>,6<i>S</i>,6a<i>R</i>)-6-hydroxy-2,2-dimethyltetrahydrofuro[4,5-<i>d</i>][1,3]dioxol-5-yl]-5-oxoisoxazolidin-2-yl}propanoate chloroform monosolvate
IUCrData, 2020, 5, x200788
1558411 CIFC16 H19 N O3P 16.398; 14.807; 16.109
75.33; 82.974; 81.03
1452.8de Diego, Heidi Lopez
Crystal Structure of (S)-1-Phenylethylammonium (R)-Mandelate and a Comparison of Diastereomeric Mandelate Salts of 1-Phenylethylamine
Acta Chemica Scandinavica, 1994, 48, 306-311
1558661 CIFC23 H34 O4P 110.715; 11.6367; 14.6771
110.288; 110.241; 91.134
1590.1Chen, Ming; Wang, Wen-Jing; Li, Ni-Ping; Zeng, Hu-Hu; Guo, Hong; Jiang, Ren-Wang; Wang, Lei; Ye, Wen-Cai
Myrcaulones A‒C, Unusual Rearranged Triketone‒Terpene Adducts from Myrciaria cauliflora
Journal of Natural Products, 2020
1558670 CIFC20 H33 F2 N O4P 18.6196; 10.2451; 12.2006
106.432; 94.759; 90.868
1029.01Hill, David R.; Abrahamson, Michael J.; Lukin, Kirill A.; Towne, Timothy B.; Engstrom, Kenneth M.; Reddy, Rajarathnam E.; Kielbus, Angelica B.; Pelc, Matthew J.; Mei, Jianzhang; Nere, Nandkishor K.; Chen, Shuang; Henry, Rodger; Chemburkar, Sanjay; Ding, Chen; Zhang, Hongqiang; Cink, Russell D.
Development of a Large-Scale Route to Glecaprevir: Synthesis of the Side Chain and Final Assembly
Organic Process Research & Development, 2020
1558671 CIFC20 H33 F2 N O4P 19.4358; 10.0861; 11.3101
94.68; 91.031; 97.524
1063.11Hill, David R.; Abrahamson, Michael J.; Lukin, Kirill A.; Towne, Timothy B.; Engstrom, Kenneth M.; Reddy, Rajarathnam E.; Kielbus, Angelica B.; Pelc, Matthew J.; Mei, Jianzhang; Nere, Nandkishor K.; Chen, Shuang; Henry, Rodger; Chemburkar, Sanjay; Ding, Chen; Zhang, Hongqiang; Cink, Russell D.
Development of a Large-Scale Route to Glecaprevir: Synthesis of the Side Chain and Final Assembly
Organic Process Research & Development, 2020
1558672 CIFC20 H33 F2 N O4P 18.6295; 10.2499; 12.1993
106.366; 94.675; 90.873
1031.06Hill, David R.; Abrahamson, Michael J.; Lukin, Kirill A.; Towne, Timothy B.; Engstrom, Kenneth M.; Reddy, Rajarathnam E.; Kielbus, Angelica B.; Pelc, Matthew J.; Mei, Jianzhang; Nere, Nandkishor K.; Chen, Shuang; Henry, Rodger; Chemburkar, Sanjay; Ding, Chen; Zhang, Hongqiang; Cink, Russell D.
Development of a Large-Scale Route to Glecaprevir: Synthesis of the Side Chain and Final Assembly
Organic Process Research & Development, 2020
1558733 CIFC70 H55 Au3 Cl6 Fe3 N3 P3P 19.8526; 10.9313; 18.774
92.519; 103.594; 95.61
1951.25Straube, Axel A.; Coburger, Peter; Duetsch, Luis; Hey-Hawkins, Evamarie
Triple the fun: Tris(ferrocenyl)arene-based gold(I) complexes for redox-switchable catalysis
Chemical Science, 2020
1559131 CIFC15 H22 O3P 18.6358; 9.3834; 9.8633
74.596; 86.938; 68.597
716.6Zhang, Jing-Fang; Zhong, Wan-Chao; Li, Yan-Cheng; Song, Yun-Qing; Xia, Gui-Yang; Tian, Gui-Hua; Ge, Guang-Bo; Lin, Sheng
Bioactivity-Guided Discovery of Human Carboxylesterase Inhibitors from the Roots of Paeonia lactiflora
Journal of Natural Products, 2020
1559262 CIFC33 H50 O9P 18.0071; 10.1293; 20.8919
84.188; 80.126; 89.579
1660.7Olivon, Florent; Retailleau, Pascal; Desrat, Sandy; Touboul, David; Roussi, Fanny; Apel, Cécile; Litaudon, Marc
Isolation of Picrotoxanes from <i>Austrobuxus carunculatus</i> Using Taxonomy-Based Molecular Networking.
Journal of natural products, 2020, 83, 3069-3079
1559263 CIFC15 H18 O6P 16.9816; 7.0672; 7.8911
81.9415; 73.77; 62.844
332.59Olivon, Florent; Retailleau, Pascal; Desrat, Sandy; Touboul, David; Roussi, Fanny; Apel, Cécile; Litaudon, Marc
Isolation of Picrotoxanes from <i>Austrobuxus carunculatus</i> Using Taxonomy-Based Molecular Networking.
Journal of natural products, 2020, 83, 3069-3079
1559265 CIFC29 H42 O9P 17.9046; 10.2052; 17.7713
96.518; 91.665; 90.773
1423.5Olivon, Florent; Retailleau, Pascal; Desrat, Sandy; Touboul, David; Roussi, Fanny; Apel, Cécile; Litaudon, Marc
Isolation of Picrotoxanes from <i>Austrobuxus carunculatus</i> Using Taxonomy-Based Molecular Networking.
Journal of natural products, 2020, 83, 3069-3079
1559659 CIFC25 H33 N O7P 15.93; 10.095; 10.946
70.69; 81.62; 89.86
611.1Schjelderup, Lise; Groth, Per A.; Aasen, Arne Jorgen
(R)-(‒)-1,1-Diphenyl-3-piperidinobutan-1-ol, an Anticholinergic Agent. The Crystal Structure of (R)-(‒)-1,1-Diphenyl-3-piperidiniobutan-1-ol (R,R)-tartrate
Acta Chemica Scandinavica, 1990, 44, 284-287
1559734 CIFC15 H20 Br Cl N2 O2P 14.9505; 8.582; 19.942
88.027; 85.435; 89.121
843.98Steigerwald, Daniel C.; Soltanzadeh, Bardia; Sarkar, Aritra; Morgenstern, Cecilia C.; Staples, Richard J.; Borhan, Babak
Ritter-enabled catalytic asymmetric chloroamidation of olefins.
Chemical science, 2020, 12, 1834-1842
1559815 CIFC29 H46 O4 SiP 16.44725; 10.18619; 22.76512
101.785; 91.4615; 98.5773
1444.75Huang, Qi; Suravarapu, Sankar Rao; Renaud, Philippe
A Giese reaction for electron-rich alkenes.
Chemical science, 2020, 12, 2225-2230
1560041 CIF
Paper
C20 H22 N4 O8P 17.7162; 8.9727; 16.9089
86.559; 78.838; 66.314
1051.59Rajkumar, Madhu; Desiraju, Gautam R.
Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol
IUCrJ, 2021, 8, 178-185
1560126 CIFC25 H18 O2P 18.6935; 11.1218; 12.2142
87.376; 70.785; 81.619
1103.26Yang, Chi; Wu, Tian-Rui; Li, Yan; Wu, Bing-Bing; Jin, Ruo-Xing; Hu, Duo-Duo; Li, Yuan-Bo; Bian, Kang-Jie; Wang, Xi-Sheng
Facile synthesis of axially chiral styrene-type carboxylic acids via palladium-catalyzed asymmetric C‒H activation
Chemical Science, 2021, 12, 3726-3732
1560262 CIFC57 H73 Cl2 N2 O3.5 P2 RuP 116.268; 17.763; 23.082
87.715; 81.35; 66.621
6051.3León, Félix; Comas-Vives, Aleix; Álvarez, Eleuterio; Pizzano, Antonio
A combined experimental and computational study to decipher complexity in the asymmetric hydrogenation of imines with Ru catalysts bearing atropisomerizable ligands
Catalysis Science & Technology, 2021, 11, 2497-2511
1560266 CIFC123 H142 Cl10 F4 N4 O6 P4 Ru2P 113.3642; 15.0349; 18.4697
89.212; 76.738; 66.771
3307.09León, Félix; Comas-Vives, Aleix; Álvarez, Eleuterio; Pizzano, Antonio
A combined experimental and computational study to decipher complexity in the asymmetric hydrogenation of imines with Ru catalysts bearing atropisomerizable ligands
Catalysis Science & Technology, 2021, 11, 2497-2511
1560319 CIFC256 H477 N60 O72.5P 19.61; 17.037; 49.01
83.751; 88.217; 74.756
7696Lee, Jin Woo; Collins, Jennifer E.; Wendt, Karen L.; Chakrabarti, Debopam; Cichewicz, Robert H.
Leveraging Peptaibol Biosynthetic Promiscuity for Next-Generation Antiplasmodial Therapeutics.
Journal of natural products, 2021, 84, 503-517
1560434 CIFAl4 B2 Ba5 N52 Si32P 19.7879; 9.792; 12.7226
96.074; 112.33; 94.08
1113.4Yoshimura, Fumitaka; Yamane, Hisanori; Nagasako, Makoto
Synthesis and crystal structure of a new aluminum-silicon-nitride phosphor containing boron, Ba 5 B 2 Al 4 Si 32 N 52 :Eu
Journal of Solid State Chemistry, 2017, 251, 43-49
1561140 CIFC78 H92 Co3 N12 O33 P2P 113.563; 13.5719; 13.6512
93.044; 110.683; 108.354
2192.77Huo, Liangqin; Fan, Liming; Zhang, Jie; Gao, Lingling; Zhai, Lijun; Wang, Xiaoqing; Hu, Tuoping
Three novel coordination polymers based on tris(p-carboxyphenyl)phosphane oxide: Syntheses, structural characterization and magnetic properties
Journal of Solid State Chemistry, 2018, 261, 37-42
1562031 CIFC30 H26 Cu3 N3 O21.5P 17.9985; 9.7296; 10.8506
84.315; 78.168; 75.064
797.6Mizzi, Jessica E.; Staples, Richard J.; LaDuca, Robert L.
Temperature-dependent polymorphism and magnetic properties of three-dimensional copper pyromellitate coordination polymers containing 4,4′-dipyridylamine
Journal of Solid State Chemistry, 2015, 225, 222-230
1562056 CIF
HKL
Paper
C40 H54 Cl4 N4 O5P 19.5944; 12.7606; 18.0312
73.9951; 79.1246; 75.2203
2035.09Anderson, Grace I.; Bellia, Sophia; Zeller, Matthias; Hillesheim, Patrick C.; Mirjafari, Arsalan
Quinine dihydrochloride hemihydrate
IUCrData, 2021, 6, x210406
1562172 CIFC18 H24 O4P 110.0882; 11.6472; 14.4851
101.004; 106.6; 96.185
1577.07Hou, Min; Xu, Mengmeng; Yang, Baochao; He, Haibing; Gao, Shuanhu
Construction of polycyclic structures with vicinal all-carbon quaternary stereocenters <i>via</i> an enantioselective photoenolization/Diels-Alder reaction.
Chemical science, 2021, 12, 7575-7582
1562348 CIFC33.5 H40 O11.5P 111.938; 12.782; 12.925
118.386; 92.327; 114.237
1512.3Sadorn, Karoon; Saepua, Siriporn; Boonyuen, Nattawut; Choowong, Wilunda; Rachtawee, Pranee; Pittayakhajonwut, Pattama
Bioactive Dimeric Tetrahydroxanthones with 2,2'- and 4,4'-Axial Linkages from the Entomopathogenic Fungus <i>Aschersonia confluens</i>.
Journal of natural products, 2021, 84, 1149-1162
1562542 CIFC21 H32 O6P 19.8531; 10.0264; 11.2177
96.693; 102.932; 106.655
1015.23Kadir, Abdukriem; Zheng, Guijuan; Zheng, Xiaofeng; Jin, Pengfei; Maiwulanjiang, Maitinuer; Gao, Biao; Aisa, Haji Akber; Yao, Guangmin
Structurally Diverse Diterpenoids from the Roots of <i>Salvia deserta</i> Based on Nine Different Skeletal Types.
Journal of natural products, 2021, 84, 1442-1452
1562986 CIFC58 H41 Cd2 Cl2 N10 O40 P W12P 111.567; 12.931; 13.907
85.52; 80.98; 76.13
1992.7Wang, La-Mei; Fan, Yong; Wang, Yan; Xiao, Li-Na; Hu, Yang-Yang; Peng, Yu; Wang, Tie-Gang; Gao, Zhong-Min; Zheng, Da-Fang; Cui, Xiao-Bing; Xu, Ji-Qing
First examples of hybrids based on polyoxometalates, metal halide clusters and organic ligands
Journal of Solid State Chemistry, 2012, 191, 257-262
1563495 CIFC10 H16 N2 O28 U5 V4P 19.6981; 9.9966; 10.5523
117.194; 113.551; 92.216
802.85Jouffret, Laurent; Shao, Zhenmian; Rivenet, Murielle; Abraham, Francis
New three-dimensional inorganic frameworks based on the uranophane-type sheet in monoamine templated uranyl-vanadates
Journal of Solid State Chemistry, 2010, 183, 2290-2297
1563513 CIFC48 H24 Ce4 O26P 17.9053; 11.7211; 15.0873
111.667; 95.073; 102.134
1248.78Pizon, David; Henry, Natacha; Loiseau, Thierry; Roussel, Pascal; Abraham, Francis
Synthesis, crystal structure and thermal behavior of two hydrated forms of lanthanide phthalates Ln2(O2+C6H4‒CO2)3(H2O) (Ln=Ce, Nd) and Nd2(O2C‒C6H4‒CO2)3(H2O)3
Journal of Solid State Chemistry, 2010, 183, 1943-1948
1563515 CIFC48 H24 Nd4 O28P 17.889; 11.57; 15.105
111.54; 95.57; 101.54
1234.3Pizon, David; Henry, Natacha; Loiseau, Thierry; Roussel, Pascal; Abraham, Francis
Synthesis, crystal structure and thermal behavior of two hydrated forms of lanthanide phthalates Ln2(O2+C6H4‒CO2)3(H2O) (Ln=Ce, Nd) and Nd2(O2C‒C6H4‒CO2)3(H2O)3
Journal of Solid State Chemistry, 2010, 183, 1943-1948
1563560 CIFC15 H28 O3P 17.4494; 9.7601; 11.3665
76.475; 86.519; 67.953
744.41Varela, Kaitlyn; Arman, Hadi D.; Yoshimoto, Francis K.
Synthesis of [15,15,15-2H3]-Dihydroartemisinic Acid and Isotope Studies Support a Mixed Mechanism in the Endoperoxide Formation to Artemisinin
Journal of Natural Products, 2021
1563750 CIFC25 H29 N O3P 16.5078; 6.7349; 25.061
88.115; 87.858; 68.927
1024Wang, Fang-Xin; Yan, Jialei; Liu, Zhixin; Zhu, Tingshun; Liu, Yingguo; Ren, Shichao; Lv, Wen-Xin; Jin, Zhichao; Chi, Yonggui Robin
Assembly of Multicyclic Isoquinoline Scaffolds from Pyridines: Formal Total Synthesis of Fredericamycin A
Chemical Science, 2021
1563799 CIFC30 H28 Cl6 Cu2 N2 O12P 112.8223; 12.8239; 38.138
89.966; 89.948; 60.027
5432.4Salman, Yeşim; Barlas, Fırat Barış; Yavuz, Murat; Kaya, Kerem; Timur, Suna; Telli, Fatma Çetin
Synthesis, characterization and biological application of dinuclear Cu(II) complexes of Schiff base ligands of galactochloralose and α-chloralose
Inorganica Chimica Acta, 2018, 483, 98-105
1563979 CIFC34 H38 Cu2 N18P 18.2229; 10.5534; 11.6684
63.751; 89.079; 77.329
882.25Jana, Abhimanyu; Brandão, Paula; Mondal, Gopinath; Bera, Pradip; Santra, Ananyakumari; Jana, Atish Dipankar; Mokhamatam, Raveendra Babu; Manna, Sunil Kumar; Bhattacharyya, Nandan; Bera, Pulakesh
Synthesis, characterization, cytotoxicity effect and DNA cleavage study of symmetric dinuclear chloro and azido bridged copper(II) complexes of napthyl-pyrazole based ligand
Inorganica Chimica Acta, 2018, 482, 621-634
1564321 CIFC102.67 H88.67 Ca0.67 N25.67 O35.17 S6P 126.6387; 28.6958; 36.1958
84.231; 71.432; 87.032
26089.9Dengler, Sebastian; Mandal, Pradeep K.; Allmendinger, Lars; Douat, Céline; Huc, Ivan
Conformational interplay in hybrid peptide‒helical aromatic foldamer macrocycles
Chemical Science, 2021
1564323 CIFC58.25 H54.88 N15.62 O18.83 S3.02P 126.454; 27.9371; 30.9544
90.9437; 92.5505; 91.4316
22843.5Dengler, Sebastian; Mandal, Pradeep K.; Allmendinger, Lars; Douat, Céline; Huc, Ivan
Conformational interplay in hybrid peptide‒helical aromatic foldamer macrocycles
Chemical Science, 2021
1564531 CIFC21 H28 O6P 18.8662; 10.0457; 12.0334
84.282; 68.413; 89.829
990.99Cao, Yunfang; Tan, Xiaosheng; Al Chnani, Ali Adhab; Li, Pengkun; Shi, Zhengyi; Feng, Hao; Sun, Lingjuan; Xia, Qiangbing; Yang, Xi; Duan, Yulin; Guo, Yi; Chen, Gang; Qi, Changxing; Zhang, Yonghui
Bioassay-Guided Isolation of an Abetiane-Type Diterpenoid from <i>Prunella vulgaris</i> That Protects against Concanavalin A-Induced Autoimmune Hepatitis.
Journal of natural products, 2021, 84, 2189-2199
1564539 CIFC40 H53 N O2P 114.806; 15.4949; 17.248
111.348; 112.174; 95.359
3288.5Zhang, Hongyan; Ma, Huili; Huang, Wenbin; Gong, Wenqi; He, Zikai; Huang, Guangxi; Li, Bing Shi; Tang, Ben Zhong
Controllable room temperature phosphorescence, mechanoluminescence and polymorphism of a carbazole derivative.
Materials horizons, 2021, 8, 2816-2822
1564601 CIFC49 H69 Cl N6P 110.9057; 14.2504; 16.844
107.383; 104.681; 104.35
2263.3Hua, Bin; Ding, Yanjun; Alimi, Lukman O.; Moosa, Basem; Zhang, Gengwu; Baslyman, Walaa S.; Sessler, Jonathan; Khashab, Niveen M.
Tuning the porosity of triangular supramolecular adsorbents for superior haloalkane isomer separations
Chemical Science, 2021
1564627 CIFC32 H43 Cl2 Ir N2 O5P 17.85321; 10.98822; 20.4662
80.0645; 81.6655; 89.1459
1721.13Bandaru, Sravan K.; Thomas, Hayden P.; Saunders, Graham C.
Piano stool complexes of N-heterocyclic carbene ligands bearing a galactose-derived substituent
Inorganica Chimica Acta, 2020, 508, 119651
1564629 CIFC32.167 H43.333 Cl2.333 N2 O5 RhP 17.8667; 10.9861; 20.5635
79.89; 81.498; 89.261
1730.21Bandaru, Sravan K.; Thomas, Hayden P.; Saunders, Graham C.
Piano stool complexes of N-heterocyclic carbene ligands bearing a galactose-derived substituent
Inorganica Chimica Acta, 2020, 508, 119651
1564800 CIFC23 H31 Cl O5P 115.1437; 17.4925; 19.3925
105.337; 92.858; 113.621
4467.9Luo, Xiaowei; Cai, Guodi; Guo, Yinfeng; Gao, Chenghai; Huang, Weifeng; Zhang, Zhenhua; Lu, Humu; Liu, Kai; Chen, Jianghe; Xiong, Xiaofeng; Lei, Jinping; Zhou, Xuefeng; Wang, Junjian; Liu, Yonghong
Exploring Marine-Derived Ascochlorins as Novel Human Dihydroorotate Dehydrogenase Inhibitors for Treatment of Triple-Negative Breast Cancer.
Journal of medicinal chemistry, 2021, 64, 13918-13932
1564802 CIFC23 H29 Cl O5P 16.1316; 11.209; 16.0507
90.884; 100.853; 93.813
1080.58Luo, Xiaowei; Cai, Guodi; Guo, Yinfeng; Gao, Chenghai; Huang, Weifeng; Zhang, Zhenhua; Lu, Humu; Liu, Kai; Chen, Jianghe; Xiong, Xiaofeng; Lei, Jinping; Zhou, Xuefeng; Wang, Junjian; Liu, Yonghong
Exploring Marine-Derived Ascochlorins as Novel Human Dihydroorotate Dehydrogenase Inhibitors for Treatment of Triple-Negative Breast Cancer.
Journal of medicinal chemistry, 2021, 64, 13918-13932
1565111 CIFC26 H32 O10P 18.2185; 8.4465; 10.2022
112.706; 95.017; 110.165
593.06Huang, Zhong-Hui; Liang, Xiao; Li, Chan-Juan; Gu, Qiong; Ma, Xuan; Qi, Shu-Hua
Talaromynoids A-I, Highly Oxygenated Meroterpenoids from the Marine-Derived Fungus <i>Talaromyces purpureogenus</i> SCSIO 41517 and Their Lipid Accumulation Inhibitory Activities.
Journal of natural products, 2021, 84, 2727-2737
1565122 CIFC30 H28 S2P 16.0023; 8.1084; 24.3715
98.319; 94.455; 92.83
1167.9Sumitomo, Kenta; Sudo, Yuta; Kanazawa, Kiseki; Kawabata, Kohsuke; Takimiya, Kazuo
Enantiopure 2-(2-ethylhexyl)dinaphtho[2,3-<i>b</i>:2',3'-<i>f</i>]thieno[3,2-<i>b</i>]thiophenes: synthesis, single-crystal structure and a surprising lack of influence of stereoisomerism on thin-film structure and electronic properties.
Materials horizons, 2022, 9, 444-451
1565123 CIFC30 H28 S2P 16.0173; 8.1041; 24.3262
98.542; 94.452; 92.932
1167.2Sumitomo, Kenta; Sudo, Yuta; Kanazawa, Kiseki; Kawabata, Kohsuke; Takimiya, Kazuo
Enantiopure 2-(2-ethylhexyl)dinaphtho[2,3-<i>b</i>:2',3'-<i>f</i>]thieno[3,2-<i>b</i>]thiophenes: synthesis, single-crystal structure and a surprising lack of influence of stereoisomerism on thin-film structure and electronic properties.
Materials horizons, 2022, 9, 444-451
1565340 CIFC21 H14 Cl4 I N O2P 18.2099; 11.6051; 12.1577
87.954; 80.589; 89.897
1142.02Shen, Chong; Cheng, Xiang; Wei, Liang; Wang, Ruo-Qing; Wang, Chun-Jiang
Stereodivergent Synthesis via Iridium-Catalyzed Asymmetric Double Allylic Alkylation of Cyanoacetate
Chemical Science, 2021
1565422 CIFC23 H34 B10 Cl3 D N2 O3 SP 110.54; 12.1568; 14.1284
71.811; 76.438; 65.487
1553.3Cao, Hou-Ji; Wei, Xing; Sun, Fangxiang; Zhang, Xiaolei; Lu, Changsheng; Yan, Hong
Metal-catalyzed B–H acylmethylation of pyridylcarboranes: access to carborane-fused indoliziniums and quinoliziniums
Chemical Science, 2021
1565423 CIFC16 H22 B10 OP 112.097; 13.28; 13.603
70.744; 72.905; 70.884
1906Cao, Hou-Ji; Wei, Xing; Sun, Fangxiang; Zhang, Xiaolei; Lu, Changsheng; Yan, Hong
Metal-catalyzed B–H acylmethylation of pyridylcarboranes: access to carborane-fused indoliziniums and quinoliziniums
Chemical Science, 2021
1565513 CIFC20 H30 O4P 16.0177; 12.9026; 13.0816
117.122; 90.99; 92.129
902.73Qi, Jing-Jing; Zhou, Jun-Su; Zhang, Yan; Fan, Yao-Yue; Zhou, Bin; Liu, Hong-Chun; Zhao, Jin-Xin; Yue, Jian-Min
Sublyratins A-O, Labdane-Type Diterpenoids from <i>Croton sublyratus</i>.
Journal of natural products, 2021, 84, 2971-2980
1565822 CIFC23 H20 I N O2P 18.7754; 8.8984; 12.8772
99.2233; 96.0361; 91.197
986.31Dishman, Sarah N.; Laconsay, Croix J.; Fettinger, James C.; Tantillo, Dean J.; Shaw, Jared T.
Divergent stereochemical outcomes in the insertion of donor/donor carbenes into the C–H bonds of stereogenic centers
Chemical Science, 2022, 13, 1030-1036
1565823 CIFC33 H27 N O3P 16.3151; 11.198; 17.7567
85.4422; 85.449; 86.8128
1246.24Dishman, Sarah N.; Laconsay, Croix J.; Fettinger, James C.; Tantillo, Dean J.; Shaw, Jared T.
Divergent stereochemical outcomes in the insertion of donor/donor carbenes into the C–H bonds of stereogenic centers
Chemical Science, 2022, 13, 1030-1036
1565825 CIF
HKL
Paper
C7 H16 O7P 16.732; 7.7574; 10.6128
82.458; 72.596; 65.476
481.13Matsumoto, Mao; Nagayama, Natsumi; Hirose, Ryo; Takeshita, Kei; Ishii, Tomohiko
Methyl α-<small>L</small>-sorboside monohydrate
IUCrData, 2021, 6, x211325
1566046 CIFC16 H19 N O3 SP 17.6588; 7.9714; 12.8907
99.211; 90.731; 99.142
766.39Iwumene, Ndidi U. N.; Moseley, Daniel. F.; Pullin, Robert D. C.; Willis, Michael C.
Diverse saturated heterocycles from a hydroacylation/conjugate addition cascade
Chemical Science, 2022, 13, 1504-1511
1566136 CIFC15 H16 N2 O3 SP 114.9664; 14.9764; 47.378
88.856; 87.71; 60.02
9191.2Jakkaraj, Sudhakar R.; Young, Victor G.; Georg, Gunda I.
Syntheses of PDE3A inhibitor ORG9935 and determination of the absolute stereochemistries of its enantiomers by X-ray crystallography
Tetrahedron, 2018, 74, 2769-2774
1566234 CIFCa0.458 Mo0.8 O8.315 U1.2P 13.9375; 11.2613; 14.195
84.4274; 112.499; 133.944
405.053Gwladys Steciuk; Radek Skoda; Jan Rohlicek; Jakub Plasil
Crystal structure of the uranyl-molybdate mineral calcurmolite Ca[(UO2)3(MoO4)2(OH)4](H2O)5 : insights from a precession electron-diffraction tomography study
Journal of GeoSciences, 2020, 65, 15-25
1566282 CIFC32 H34 O11P 17.3468; 9.587; 10.3986
71.686; 80.813; 86.65
686.37Cao, Hai-Yan; Yi, Cheng; Sun, Sen-Feng; Li, Yong; Liu, Yun-Bao
Anti-inflammatory Dimeric Tetrahydroxanthones from an Endophytic <i>Muyocopron laterale</i>.
Journal of natural products, 2022, 85, 148-161
1566283 CIFC33 H40 O14P 17.2806; 9.8268; 11.0309
85.062; 88.911; 86.614
784.83Cao, Hai-Yan; Yi, Cheng; Sun, Sen-Feng; Li, Yong; Liu, Yun-Bao
Anti-inflammatory Dimeric Tetrahydroxanthones from an Endophytic <i>Muyocopron laterale</i>.
Journal of natural products, 2022, 85, 148-161
1566357 CIFAl2 H4 O9 Si2P 15.185369; 8.997871; 7.347378
91.7552; 105.095; 89.8358
330.82Richard, D; Rendtorff, N M
Kaolin group minerals under pressure: The study of their structural and electronic properties by DFT methods
Applied Clay Science, 2022, 219, 106444-106444
1566358 CIFAl2 H4 O9 Si2P 15.210756; 5.189703; 7.581904
89.3723; 72.4369; 119.963
166.073Richard, D; Rendtorff, N M
Kaolin group minerals under pressure: The study of their structural and electronic properties by DFT methods
Applied Clay Science, 2022, 219, 106444-106444
1566359 CIFAl2 H4 O9 Si2P 15.162169; 5.176777; 7.781752
104.444; 98.2915; 119.884
165.438Richard, D; Rendtorff, N M
Kaolin group minerals under pressure: The study of their structural and electronic properties by DFT methods
Applied Clay Science, 2022, 219, 106444-106444
1566360 CIFAl2 H4 O9 Si2P 15.159081; 8.934001; 14.410312
90; 96.3063; 90
660.17Richard, D; Rendtorff, N M
Kaolin group minerals under pressure: The study of their structural and electronic properties by DFT methods
Applied Clay Science, 2022, 219, 106444-106444
1566361 CIFAl2 H4 O9 Si2P 15.185121; 8.939635; 14.188437
90.001; 89.08; 89.9997
657.593Richard, D; Rendtorff, N M
Kaolin group minerals under pressure: The study of their structural and electronic properties by DFT methods
Applied Clay Science, 2022, 219, 106444-106444
1566362 CIFAl2 H4 O9 Si2P 18.902908; 5.163177; 14.518933
90.0004; 99.3478; 90
658.533Richard, D; Rendtorff, N M
Kaolin group minerals under pressure: The study of their structural and electronic properties by DFT methods
Applied Clay Science, 2022, 219, 106444-106444
1566543 CIFC280 H320 N32 O40P 128.4101; 30.2731; 32.7364
82.444; 81.795; 63.273
24818Xu, Ning; Su, Kongzhao; M. El-Sayed, El-Sayed; Ju, Zhanfeng; Yuan, Daqiang
Chiral Proline-Substituted Porous Organic Cages in Asymmetric Organocatalysis
Chemical Science, 2022
1566546 CIFC32 H39 Cl3 Cu N8 O3P 17.2313; 9.2604; 14.1201
78.16; 77.214; 70.423
859.9Wittmann, Christopher; Bacher, Felix; Enyedy, Eva A.; Dömötör, Orsolya; Spengler, Gabriella; Madejski, Christian; Reynisson, Jóhannes; Arion, Vladimir B.
Highly Antiproliferative Latonduine and Indolo[2,3-<i>c</i>]quinoline Derivatives: Complex Formation with Copper(II) Markedly Changes the Kinase Inhibitory Profile.
Journal of medicinal chemistry, 2022, 65, 2238-2261
1566592 CIFC23 H22 O3 SP 17.2748; 12.2905; 12.5063
63.599; 79.446; 75.302
965.6Li, Yanjun; Liou, Yan-Cheng; Chen, Xinran; Ackermann, Lutz
Thioether-enabled palladium-catalyzed atroposelective C–H olefination for N−C and C−C axial chirality
Chemical Science, 2022
1566771 CIFC198 H239 N40 O31 P2P 113.8456; 13.8504; 26.594
98.63; 90.112; 101.91
4930.7Li, Hongfei; Kou, Lei; Liang, Lin; Li, Boyang; Zhao, Wei; Yang, Xiao-Juan; Wu, Biao
Anion-coordination-driven single-double helix switching and chiroptical molecular switch based on oligoureas
Chemical Science, 2022
1566792 CIFC20 H17 N SP 18.3698; 8.6024; 11.6963
103.438; 103.111; 102.977
762.79Yan, Qiaolin; Duan, Meng; Chen, Cien; Deng, Zhiqin; Wu, Mandi; Yu, Peiyuan; He, Ming-Liang; Zhu, Guangyu; Houk, Kendall N.; Sun, Jianwei
Organocatalytic Discrimination of Non-Directing Aryl and Heteroaryl Groups: Enantioselective Synthesis of Bioactive Indole-Containing Triarylmethanes
Chemical Science, 2022
1566793 CIFC20 H17 N SP 18.4366; 8.5299; 11.8199
103.482; 103.756; 102.858
767.86Yan, Qiaolin; Duan, Meng; Chen, Cien; Deng, Zhiqin; Wu, Mandi; Yu, Peiyuan; He, Ming-Liang; Zhu, Guangyu; Houk, Kendall N.; Sun, Jianwei
Organocatalytic Discrimination of Non-Directing Aryl and Heteroaryl Groups: Enantioselective Synthesis of Bioactive Indole-Containing Triarylmethanes
Chemical Science, 2022
1566824 CIFC22 H20 O2 S2P 17.0221; 7.9102; 9.5017
106.659; 105.234; 101.17
466.74Zhou, Jun; Mao, Lijun; Wu, Meng-Xiang; Peng, Zhiyong; Yang, Yiming; Zhou, Manfei; Zhao, Xiao-Li; Shi, Xueliang; Yang, Hai-Bo
Extended phenothiazines: synthesis, photophysical and redox properties, and efficient photocatalytic oxidative coupling of amines
Chemical Science, 2022
1566855 CIFC18 H36 N2 O2 P2P 110.1507; 10.483; 12.0198
71.0631; 77.4831; 65.8533
1098.71Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S.
A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines
Chemical Science, 2022
1566857 CIFC27 H47 N3 O P2P 19.5345; 11.9909; 13.3121
104.379; 90.136; 94.2154
1469.93Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S.
A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines
Chemical Science, 2022
1566861 CIFC27 H47 N3 O P2P 19.5482; 12.0125; 13.2604
103.899; 90.8396; 94.8447
1470.17Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S.
A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines
Chemical Science, 2022
1566863 CIFC27 H47 N3 O P2P 19.5547; 11.9843; 13.3167
103.719; 90.305; 94.423
1476.49Peel, Andrew J.; Terzopoulos, Alexandros; Jethwa, Rajesh B.; Choudhury, Dipanjana; Niu, Hao-Che; Bond, Andrew D.; Slaughter, Jonathan; Wright, Dominic S.
A chiral phosphazane reagent strategy for the determination of enantiomeric excess of amines
Chemical Science, 2022
1566957 CIFC40 H38 O10P 113.5907; 15.0346; 18.9632
97.644; 101.994; 104.537
3598Zhao, Gaoyuan; Mukherjee, Upasana; Zhou, Lin; Wu, Yue; Yao, Wang; Mauro, Jaclyn N.; Liu, Peng; Ngai, Ming-Yu
C2-ketonylation of carbohydrates via excited-state palladium-catalyzed 1,2-spin-center shift
Chemical Science, 2022
1567023 CIFC30 H15 I N9P 17.168; 7.6291; 13.6797
78.422; 83.441; 69.68
686.44Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka
Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals
IUCrJ, 2022, 9
1567037 CIFC30 H15 I N9P 17.0735; 7.8171; 13.8419
74.353; 88.928; 67.934
680.1Molčanov, Krešimir; Milašinović, Valentina; Kojić-Prodić, Biserka; Maltar-Strmečki, Nadica; You, Jiangyang; Šantić, Ana; Kanižaj, Lidija; Stilinović, Vladimir; Fotović, Luka
Semiconductive 2D arrays of pancake-bonded oligomers of partially charged TCNQ radicals
IUCrJ, 2022, 9
1567048 CIFC53 H37 N11 O4P 110.1334; 10.2002; 11.4807
93.3946; 99.9779; 107.948
1103.79Gorai, Tumpa; Lovitt, June I.; Umadevi, Deivasigamani; McManus, Gavin; Gunnlaugsson, Thorfinnur
Hierarchical supramolecular co-assembly formation employing multi-component light-harvesting charge transfer interactions giving rise to long-wavelength emitting luminescent microspheres.
Chemical science, 2022, 13, 7805-7813
1567049 CIFC75.5 H85.5 Cl10.5 N12 O12P 112.733; 13.433; 14.738
63.059; 71.223; 73.702
2100.3Al Kelabi, Dana; Dey, Avishek; Alimi, Lukman O.; Piwoński, Hubert; Habuchi, Satoshi; Khashab, Niveen M.
Photostable polymorphic organic cages for targeted live cell imaging
Chemical Science, 2022, 13, 7341-7346
1567274 CIFC19 H15 F2 N OP 15.5106; 7.7117; 9.6692
70.09; 86.972; 85.438
384.97Liu, Zhen; Wei, Yin; Shi, Min
A concise method for cyclic gem-difluoroacyl scaffolds via visible-light-mediated redox-neutral cascade radical cyclization of alkenes
Catalysis Science & Technology, 2022, 12, 5325-5331
1567304 CIFC72 H162 N2 O25 Rb2 Si6 U2P 114.0149; 17.5229; 24.7263
83.4471; 83.4537; 70.099
5654Jori, Nadir; Rajeshkumar, Thayalan; Scopelliti, Rosario; Z̆ivković, Ivica; Sienkiewicz, Andrzej; Maron, Laurent; Mazzanti, Marinella
Cation assisted binding and cleavage of dinitrogen by uranium complexes
Chemical Science, 2022, 13, 9232-9242
1567424 CIFC66 H81 Br Cl12 N4 O2 P2 RuP 111.3315; 12.2669; 14.2038
77.65; 88.094; 75.63
1867.9Böth, Alexander D.; Sauer, Michael J.; Baratta, Walter; Kühn, Fritz E.
Abnormal NHC ruthenium catalysts: mechanistic investigations of their preparation and steric influence on catalytic performance
Catalysis Science & Technology, 2022, 12, 5597-5603
1567434 CIFC22 H18 N2 O2 SiP 16.1626; 8.8822; 26.4639
88.692; 88.561; 81.453
1431.76Seidel, Anne; Weigel, Mareike; Ehrlich, Lisa; Gericke, Robert; Brendler, Erica; Wagler, Jörg
Molecular Structures of the Silicon Pyridine-2-(thi)olates Me3Si(pyX), Me2Si(pyX)2 and Ph2Si(pyX)2 (py = 2-Pyridyl, X = O, S), and Their Intra- and Intermolecular Ligand Exchange in Solution
Crystals, 2022, 12, 1054
1567460 CIFC4 H5 Br0.12 I0.12 N0.25 O0.5P 15.69; 8.341; 17.5111
79.981; 82.483; 89.991
811.16Garain, Swadhin; Ansari, Shagufi Shagufi Naz; Kongasseri, Anju; GARAIN, BIDHAN CHANDRA; Pati, Swapan K.; George, Subi J.
Room Temperature Charge-Transfer Phosphorescence from Organic Donor-Acceptor Co-Crystals
Chemical Science, 2022
1567521 CIFC26.75 H41 O6.75P 110.086; 15.2512; 17.1263
91.211; 99.494; 98.375
2567.88Tang, Jia; Matsuda, Yudai
Discovery of branching meroterpenoid biosynthetic pathways in Aspergillus insuetus: involvement of two terpene cyclases with distinct cyclization modes
Chemical Science, 2022
1567522 CIFC34 H36 Cl P2 RhP 110.3091; 12.7665; 13.3424
107.864; 101.093; 112.099
1451.17Som, Salina; Choi, Jongwook; Katsoulis, Dimitris; Lee, Kangsang L.
Direct Method to Access Various Functional Arylalkoxysilanes by Rh-catalysed Intermolecular C–H Silylation of Alkoxysilane
Chemical Science, 2022
1567763 CIFC12 H10 Br F N2 SP 14.5926; 5.6626; 12.165
86.311; 88.909; 81.003
311.81Zhao, Ruyan; Zhu, Tong; Wang, Sasa; Jarrett-Wilkins, Charlie; Najjarian, Amin Morteza; Lough, Alan J.; Hoogland, Sjoerd; Sargent, Edward H.; Seferos, Dwight S.
Engineering hydrogen bonding to align molecular dipoles in organic solids for efficient second harmonic generation
Chemical Science, 2022, 13, 12144-12148
1567766 CIF
Paper
C35 H57.5 N O3.25P 111.8289; 16.7287; 17.7234
116.207; 91.0059; 100.454
3075.4Campos Fernandez, Cristian; Procupez-Schtirbu, R.; Soto-Tellini, V. H.; Salazar, J. C.; Jancik, Vojtech
(1<i>S</i>,3<i>R</i>)-<i>N</i>-{(3<i>S</i>,10<i>S</i>,12<i>S</i>,13<i>R</i>,17<i>R</i>)-12-Hydroxy-17-[(<i>R</i>)-5-hydroxypentan-2-yl]-10,13-dimethylhexadecahydro-1<i>H</i>-cyclopenta[<i>a</i>]phenanthren-3-yl}adamantane-1-carboxamide 0.25-hydrate
IUCrData, 2022, 7, x220947
1567861 CIFC31 H37 N3 O6P 19.2497; 9.6644; 32.938
90.062; 92.44; 104.738
2844.7Misra, Rajkumar; Netti, Francesca; Koren, Gil; Dan, Yoav; Chakraborty, Priyadarshi; Cohen, Sidney R.; Shimon, Linda J. W.; Beck, Roy; Adler-Abramovich, Lihi
An atomistic view of rigid crystalline supramolecular polymers derived from short amphiphilic, α,β hybrid peptide
Polymer Chemistry, 2022, 13, 6223-6228
1568026 CIFC60 H52 N4 O4P 18.3457; 9.3455; 17.6411
95.16; 99.293; 115.715
1203.41Tian, Xiaoqi; Shoyama, Kazutaka; Würthner, Frank
Nitrogen-doped polycyclic aromatic hydrocarbons by a one-pot Suzuki coupling/intramolecular S<sub>N</sub>Ar reaction.
Chemical science, 2023, 14, 284-290
1568045 CIFC51 H58 O5P 110.6821; 12.0842; 17.057
93.142; 105.229; 97.685
2096.06Zhang, Xin; Tong, Shuo; Zhu, Jieping; Wang, Mei-Xiang
Inherently chiral calixarenes by a catalytic enantioselective desymmetrizing cross-dehydrogenative coupling.
Chemical science, 2023, 14, 827-832
1568221 CIFC18 H20 N4 O4P 15.189; 7.915; 10.643
80.745; 82.34; 88.94
427.6De, Soumi; Asthana, Deepak; Thirmal, Chinthakuntla; Keshri, Sudhir K.; Ghosh, Ram Krishna; Hundal, Geeta; Kumar, Raju; Singh, Satyendra; Chatterjee, Ratnamala; Mukhopadhyay, Pritam
A folded π-system with supramolecularly oriented dipoles: single-component piezoelectric relaxor with NLO activity.
Chemical science, 2023, 14, 2547-2552
1568279 CIFC36 H16 N6 OP 17.023; 9.909; 11.109
65.89; 74.66; 73.28
666.2Chen, Jinqiu; Yang, Canglei; Ma, Shuang; Liu, Zhiqi; Xiang, Wenxin; Zhang, Jing
Polarization-induced nanohelixes of organic cocrystals from asymmetric components with dopant-induced chirality inversion.
Chemical science, 2023, 14, 2091-2096
1568593 CIFC96 H110 Cl42 Mo18 O97P 117.8167; 17.9076; 19.7519
116.936; 116.807; 90.012
4846Ivanov, Anton A.; Abramov, Pavel A.; Haouas, Mohamed; Molard, Yann; Cordier, Stéphane; Falaise, Clément; Cadot, Emmanuel; Shestopalov, Michael A.
Supramolecular Host–Guest Assemblies of [M6Cl14]2–, M = Mo, W, Clusters with γ-Cyclodextrin for the Development of CLUSPOMs
Inorganics, 2023, 11, 77
1568598 CIFFe16 O128 P12 S4P 113.3722; 13.3488; 21.585
92.345; 90.153; 120.34
3321.3Mauro, Daniela; Biagioni, Cristian
New Crystal-Structure Data on Bohuslavite, Fe3+4(PO4)3(SO4)(OH)(H2O)10·nH2O
Minerals, 2023, 13, 286
1568607 CIFC20 H21 O7P 18.78; 8.92; 11.62
84.56; 81.25; 76.39
872.6Mathew, Shintu; Zhang, Kenneth; Zhou, Xian; Münch, Gerald; Bodkin, Francis; Li, Feng; Raju, Ritesh
Myrtinols A–F: New Anti-Inflammatory Peltogynoid Flavonoid Derivatives from the Leaves of Australian Indigenous Plant Backhousia myrtifolia
Molecules, 2023, 28, 2160
1568620 CIFC90 H51 B3 Br6P 110.2031; 11.8054; 16.122
74.925; 89.781; 89.984
1875.08Guo, Jing; Zhang, Kaihua; Wang, Yanpei; Wei, Haipeng; Xiao, Wang; Yang, Kun; Zeng, Zebing
Fully-fused boron-doped olympicenes: modular synthesis, tunable optoelectronic properties, and one-electron reduction.
Chemical science, 2023, 14, 4158-4165
1569002 CIFC76 H104 O12P 19.5123; 11.7533; 16.8232
109.487; 90.441; 100.671
1737.54Chen, Xiao-Wei; Hou, Zi-Chao; Chen, Chi; Zhang, Ling-Hui; Chen, Meng-En; Zhang, Fu-Min
Enantioselective total syntheses of six natural and two proposed meroterpenoids from <i>Psoralea corylifolia</i>.
Chemical science, 2023, 14, 5699-5704
1569044 CIFC37 H18 Ag3 F18 N7 OP 17.8326; 11.0556; 12.8446
114.754; 102.718; 94.914
965.22Olbrykh, Arina; Titov, Aleksei; Smol’yakov, Alexander; Filippov, Oleg; Shubina, Elena S.
Exploring the Interaction of Pyridine-Based Chalcones with Trinuclear Silver(I) Pyrazolate Complex
Inorganics, 2023, 11, 175
1569120 CIFC132 H128 Cl4 N16 O2 Zn3P 112.967; 14.683; 17.866
82.663; 72.777; 72.012
3087.8Dhamija, Avinash; Chandel, Dolly; Rath, Sankar Prasad
Modulation of supramolecular chirality by stepwise axial coordination in a nano-size trizinc(ii)porphyrin trimer.
Chemical science, 2023, 14, 6032-6038
1569347 CIFC38 H29 Cl2 N2 O6 S2P 16.7397; 8.1678; 16.0806
93.714; 95.548; 96.111
873.54Lin, Han-Ze; Qi, Zhuang; Wu, Qi-Min; Jiang, Yong-Yu; Peng, Jin-Bao
Palladium-catalyzed intramolecular asymmetric hydrocyclopropanylation of alkynes: synthesis of cyclopropane-fused γ-lactams.
Chemical science, 2023, 14, 7564-7568
1569454 CIFC31 H25 N2 O2 SP 18.348; 9.154; 16.683
98.03; 92.58; 90.2
1261Si, Xiao-Ju; Zhao, Xiaofang; Wang, Jianli; Wang, Xinhai; Zhang, Yuanshuo; Yang, Dandan; Song, Mao-Ping; Niu, Jun-Long
Cobalt-catalyzed enantioselective C-H/N-H annulation of aryl sulfonamides with allenes or alkynes: facile access to C-N axially chiral sultams.
Chemical science, 2023, 14, 7291-7303
1569499 CIFC70 H56 F8 N8 O11.5 S2P 18.927; 13.6209; 14.7225
101.208; 104.314; 101.04
1646.58Guo, Shen-Yi; Zhang, Zhuo-Ang; Tong, Shuo; Guo, Qing-Hui; Hua, Ruimao; Wang, Mei-Xiang
Tetrahomo corona[4]arene-based spirophanes: synthesis, structure, and properties.
Chemical science, 2023, 14, 8393-8400
1569585 CIFC180.23 H165.95 Cl4.45P 19.72613; 19.54803; 20.00438
75.8276; 76.6215; 89.241
3583.73Obermann, Sebastian; Zheng, Wenhao; Melidonie, Jason; Böckmann, Steffen; Osella, Silvio; Arisnabarreta, Nicolás; Guerrero-León, L Andrés; Hennersdorf, Felix; Beljonne, David; Weigand, Jan J.; Bonn, Mischa; De Feyter, Steven; Hansen, Michael Ryan; Wang, Hai I.; Ma, Ji; Feng, Xinliang
Curved graphene nanoribbons derived from tetrahydropyrene-based polyphenylenes <i>via</i> one-pot K-region oxidation and Scholl cyclization.
Chemical science, 2023, 14, 8607-8614
1569727 CIFC58 H44 O2 P2P 19.2214; 13.2109; 18.8909
95.7; 99.414; 101.148
2207Yang, Bo; Yan, Suqiong; Li, Chengbo; Ma, Hui; Feng, Fanda; Zhang, Yuan; Huang, Wei
Mn(iii)-mediated C-P bond activation of diphosphines: toward a highly emissive phosphahelicene cation scaffold and modulated circularly polarized luminescence.
Chemical science, 2023, 14, 10446-10457
1569759 CIFC30 H52 N4 O5P 19.549; 13.356; 14.7285
108.404; 103.569; 95.911
1700.38Rabaud, Dorian; Dussart, Paul; Ducouret, Guylaine; Albouy, Pierre-Antoine; Forté, Jérémy; Isare, Benjamin; Bouteiller, Laurent
Development of furan-2,5-dicarboxylic acid (FDCA)-based organogelators.
Soft matter, 2023, 19, 6958-6967
1569819 CIFC77 H70 F3 N8 O3 Pt2 SP 17.2605; 14.3218; 18.004
70.891; 86.709; 84.755
1760.8Jing, Jing; Yu, Miao; Pan, Lei; Zhao, Yang; Xu, Guo; Zhang, Hua-Hong; Li, Chen; Zhang, Xiao-Peng
Synthesis and Biological Activities of Luminescent 5,6-Membered Bis(Metallacyclic) Platinum(II) Complexes
Molecules, 2023, 28, 6369
1569908 CIFC32 H27 F N2 O3 SP 19.253; 9.3566; 9.9037
106.668; 101.698; 117.979
665.24Jiang, Bo; Gui, Wu-Tao; Wang, Hao-Tian; Xie, Ke; Chen, Zhi-Chao; Zhu, Lei; Ouyang, Qin; Du, Wei; Chen, Ying-Chun
Asymmetric Friedel-Crafts reaction of unsaturated carbonyl-tethered heteroarenes <i>via</i> vinylogous activation of Pd<sup>0</sup>-π-Lewis base catalysis.
Chemical science, 2023, 14, 10867-10874
1569945 CIFC128 H296 Ce2 Cs2 N32 O4 P8P 113.915; 13.928; 24.247
105.027; 96.887; 109.734
4159.3Boggiano, Andrew C.; Studvick, Chad M.; Steiner, Alexander; Bacsa, John; Popov, Ivan A.; La Pierre, Henry S.
Structural distortion by alkali metal cations modulates the redox and electronic properties of Ce<sup>3+</sup> imidophosphorane complexes.
Chemical science, 2023, 14, 11708-11717
1569963 CIFC53 H47 O10 P3P 18.3298; 11.7921; 23.5575
75.792; 87.279; 77.21
2187.46Jiao, Jianmin; Li, Heng; Xie, Wang; Zhao, Yue; Lin, Chen; Jiang, Juli; Wang, Leyong
Host-guest system of a phosphorylated macrocycle assisting structure determination of oily molecules in single-crystal form.
Chemical science, 2023, 14, 11402-11409
1569968 CIFC51 H48 N O12 P3P 19.6588; 16.0406; 16.414
62.242; 89.152; 84.69
2239.6Jiao, Jianmin; Li, Heng; Xie, Wang; Zhao, Yue; Lin, Chen; Jiang, Juli; Wang, Leyong
Host-guest system of a phosphorylated macrocycle assisting structure determination of oily molecules in single-crystal form.
Chemical science, 2023, 14, 11402-11409
1569970 CIFC61 H59 O11 P3P 111.0428; 15.3355; 16.784
93.686; 100.727; 107.398
2642.99Jiao, Jianmin; Li, Heng; Xie, Wang; Zhao, Yue; Lin, Chen; Jiang, Juli; Wang, Leyong
Host-guest system of a phosphorylated macrocycle assisting structure determination of oily molecules in single-crystal form.
Chemical science, 2023, 14, 11402-11409
1569972 CIFC61 H59 O11 P3P 111.0451; 15.3389; 16.7639
93.606; 100.717; 107.383
2641.81Jiao, Jianmin; Li, Heng; Xie, Wang; Zhao, Yue; Lin, Chen; Jiang, Juli; Wang, Leyong
Host-guest system of a phosphorylated macrocycle assisting structure determination of oily molecules in single-crystal form.
Chemical science, 2023, 14, 11402-11409
1570139 CIFC11 H10 Cu N OP 18.069; 13.7637; 16.3101
70.036; 89.552; 89.76
1702.48Boudie, Claire; Maréchal, Manuel; Ah-Lung, Guillaume; Jacquemin, Johan; Nockemann, Peter
Tuneable-by-design copper oxide nanoparticles in ionic liquid nanofluids.
Nanoscale, 2023, 15, 18423-18434
1570175 CIFC42 H34 F2 O8 S6P 19.6128; 10.2795; 12.5045
103.159; 96.871; 116.633
1040.05Zhang, Ying; Yang, Jimin; Ruan, Yu-Long; Liao, Ling; Ma, Chuang; Xue, Xiao-Song; Yu, Jin-Sheng
Nickel-catalysed asymmetric hydromonofluoromethylation of 1,3-enynes for enantioselective construction of monofluoromethyl-tethered chiral allenes.
Chemical science, 2023, 14, 12676-12683
1570277 CIFC51 H50 Cl6 Mn3 N15 O31P 111.82; 12.7584; 13.3067
109.691; 107.464; 99.058
1726Mu, Ge; Gaynor, Ryan B.; McIntyre, Baylee N.; Donnadieu, Bruno; Creutz, Sidney E.
Synthesis and Characterization of Bipyridyl-(Imidazole)<sub>n</sub> Mn(II) Compounds and Their Evaluation as Potential Precatalysts for Water Oxidation.
Molecules (Basel, Switzerland), 2023, 28, 7221
1570373 CIFC136 H90 Cl2 N4 O16P 113.2705; 21.6957; 22.113
111.223; 102.466; 104.738
5394.3Weh, Manuel; Kroeger, Asja A.; Anhalt, Olga; Karton, Amir; Würthner, Frank
Mutual induced fit transition structure stabilization of corannulene's bowl-to-bowl inversion in a perylene bisimide cyclophane.
Chemical science, 2024, 15, 609-617
1570431 CIFC33 H30.13 N2 O2P 16.8195; 19.5313; 20.5319
96.793; 95.64; 99.888
2655.5Mazzarella, Daniele; Bortolato, Tommaso; Pelosi, Giorgio; Dell'Amico, Luca
Photocatalytic (3 + 2) dipolar cycloadditions of aziridines driven by visible-light.
Chemical science, 2023, 15, 271-277
1570453 CIFC54 H74 N2 O8P 16.10213; 7.30975; 29.70773
92.3183; 93.944; 114.298
1201.43Zhang, Fan; Wang, Su-Jing; Xiao, Wen; Yu, Ming-Zhu; Sha, Feng; Wu, Ruibo; Xiang, Zheng
Harnessing the catalytic plasticity of the ent-kaurene synthase from Bradyrhizobium japonicum to produce the ent-rosane and ent-pimarane scaffolds
Catalysis Science & Technology, 2024, 14, 306-314
1570801 CIFC26 H38 O6P 19.061; 11.978; 12.657
107.62; 110.74; 93.69
1202Yan, Dexiu; Matsuda, Yudai
Global genome mining-driven discovery of an unusual biosynthetic logic for fungal polyketide-terpenoid hybrids.
Chemical science, 2024, 15, 3011-3017
1570894 CIFC168 H168 Ni12 S24P 115.8579; 19.165; 19.177
87.841; 81.039; 82.464
5706.5Xiang, Huixin; Cheng, Ranran; Ruan, Chenhao; Meng, Changqing; Gan, Yuzheng; Cheng, Wanyu; Zhao, Yue; Xu, Cong-Qiao; Li, Jun; Yao, Chuanhao
A homologous series of macrocyclic Ni clusters: synthesis, structures, and catalytic properties.
Nanoscale, 2024, 16, 4563-4570
1570971 CIFC27 H19 N O2P 17.8226; 9.87; 13.4677
72.435; 82.536; 83.621
980.1Qian, Chenxiao; Huang, Jing; Huang, Tingting; Song, Lijuan; Sun, Jianwei; Li, Pengfei
Organocatalytic enantioselective synthesis of C<sub>sp<sub>2</sub></sub>-N atropisomers <i>via</i> formal C<sub>sp<sub>2</sub></sub>-O bond amination.
Chemical science, 2024, 15, 3893-3900
1571016 CIFC20 H54 O2 Si8P 19.2895; 9.5681; 12.3723
93.065; 108.756; 118.62
885.12Glotz, Gabriel; Drusgala, Manfred; Hamm, Florian; Fischer, Roland C.; Došlić, Nađa; Kelterer, Anne-Marie; Gescheidt, Georg; Haas, Michael
Wavelength-dependent rearrangements of an α-dione chromophore: a chemical pearl in a bis(hypersilyl) oyster.
Chemical science, 2024, 15, 4427-4433
1571052 CIFC24 H54 Li N Si2P 111.12464; 14.7718; 17.2761
86.9319; 72.3912; 76.3044
2628.53Knüpfer, Christian; Klerner, Lukas; Mai, Jonathan; Langer, Jens; Harder, Sjoerd
s-Block metal complexes of superbulky (<sup><i>t</i></sup>Bu<sub>3</sub>Si)<sub>2</sub>N<sup>-</sup>: a new weakly coordinating anion?
Chemical science, 2024, 15, 4386-4395
1571372 CIFC15 H13 N O5P 16.9794; 7.6259; 12.3471
93.144; 97.362; 94.061
648.752Mondal, Saikat; Reddy, C. Malla; Saha, Subhankar
Crystal property engineering using molecular-supramolecular equivalence: mechanical property alteration in hydrogen bonded systems.
Chemical science, 2024, 15, 3578-3587
1571410 CIFC39 H29 P SP 111.039; 15.1879; 16.0708
112.211; 104.135; 103.663
2251.2Sun, Jinghui; Yan, Yifei; Chen, Xuanxuan; Huang, Zhiwei; Huang, Yinhua
Palladium-Catalyzed Regio- and Stereoselective Phosphination of Cyclic Biarylsulfonium Salts to Access Atropoisomeric Phosphines
Chemical Science, 2024
1571491 CIFC17 H18 O2P 112.2029; 12.207; 20.231
106.041; 106.066; 90.658
2770.52Ding, Bo; Xue, Qilin; Wei, Han; Chen, Jiangwei; Liu, Ze-Shui; Cheng, Hong-Gang; Cong, Hengjiang; Tang, Jianting; Zhou, Qianghui
Enantioconvergent Synthesis of Chiral Fluorenols from Racemic Secondary Alcohols via Pd(II)/Chiral Norbornene Cooperative Catalysis
Chemical Science, 2024
1571506 CIFC10 H13 F13 N4 Sb4P 17.2222; 8.1293; 10.3779
101.002; 105.247; 106.829
538.65Wu, Jia-Hang; Hu, Chun-Li; Li, Yafeng; Mao, Jiang-Gao; Kong, Fang
[(C5H6N2)2H](Sb4F13): A polyfluoroantimonite with strong second harmonic generation effect
Chemical Science, 2024
1571527 CIFC96 H70 Br4 N4 O10P 110.42669; 12.40814; 18.05325
79.3587; 81.0124; 87.8419
2267.21Lin, Zeng-Gang; Zhang, Peng; Song, Fu-Qiang; Yang, Yuzhu; Miao, Xuan; Liu, Wei-Sheng
By employing racemization strategies to simultaneously enhance the quantum yield, lifetime, and water stability of room-temperature phosphorescent materials
Chemical Science, 2024
1571565 CIFC41 H35 F N2 O5P 19.0844; 10.3859; 18.7463
75.426; 89.765; 88.695
1711.35Wang, Baomin; Wang, Yue; Huang, Yue; Bao, Xiaoze; Wei, Xingfu; Wei, Shiqiang; Qu, Jingping
Organocatalytic diastereo- and atroposelective construction of eight-membered bridged (hetero)biaryls via asymmetric intramolecular [3+2] cycloaddition
Chemical Science, 2024
1571595 CIFC39 H29 N O2 S2P 18.766; 11.916; 15.464
101.43; 92.94; 111.2
1462.7Khatun, Mst Nasima; Nandi, Satyendu; Roy, Hirakjyoti; Ghosh, Siddhartha Sankar; Kumar, Sachin; Iyer, Parameswar K.
Sulphur-Atom Positional Engineering in Perylenimide: Structure-Property Relationships and H-aggregation Directed Type-I Photodynamic Therapy
Chemical Science, 2024
2000294 CIF
Paper
C27 H32 N2 O7P 111.076; 11.314; 12.155
104.41; 102.02; 89.37
1441.6Driessen, R. A. J.; Fraanje, J.
Structure of methyl (4a<i>S</i>,5<i>R</i>,7a<i>R</i>,11a<i>R</i>,12a<i>S</i>)-2-benzyl-2,3,4,4a,5,6,7,7a,8,10,11a,12-dodecahydro-7,7-(ethylenedioxy)-1,9-dioxooxazolo[3',4':1,2]pyrrolo[5,4-<i>i</i>]isoquinoline-5-carboxylate toluene (2/1)
Acta Crystallographica Section C, 1991, 47, 1554-1557
2000392 CIF
Paper
C20 H19 O3.5 S3P 112.488; 10.372; 8.335
84.95; 108.74; 98.51
1010.2Dillen, J. L. M.; Roos, H. M.
Structure of tris(5-acetyl-3-thienyl)methane-ethanol (2/1) inclusion compound
Acta Crystallographica Section C, 1992, 48, 2229-2231
2000686 CIF
Paper
C67 H120 O38P 110.673; 15.776; 16.103
122.77; 110.09; 68.13
2080.5Rysanek, N.; Le Bas, G.; Villain, F.; Tsoucaris, G.
Structure of the (1:1:1) complex 2<i>a</i>,2<i>b</i>,2<i>c</i>,2<i>d</i>,2<i>e</i>,2<i>f</i>,3<i>a</i>,3<i>g</i>,6<i>a</i>,6<i>b</i>,6<i>c</i>,6<i>d</i>,6<i>e</i>,6<i>f</i>,6<i>g</i>-pentadeca-<i>O</i>-methyl-β-cyclodextrin-1,7-dioxaspiro[5.5]undecane-methanol
Acta Crystallographica Section C, 1992, 48, 1466-1471
2000855 CIF
Paper
C15 H26 O4 S2P 16.46; 8.917; 15.616
83.6; 83.41; 89.52
888Lynch, V. M.; Lee, W.-C.; Martin, S. F.; Davis, B. E.
Structure of a protected C3-C10 subunit of erythromycin and its C8 epimer
Acta Crystallographica Section C, 1992, 48, 1145-1148
2001143 CIF
Paper
C30 H66 Cl6 Er2 N6 O42P 113.003; 13.639; 9.861
110.26; 100.94; 109.35
1453.5Hu, N.-H.; Wang, Z.-L.; Niu, C.-J.; Ni, J.-Z.
Structure of an erbium complex with <small>L</small>-proline
Acta Crystallographica Section C, 1993, 49, 2086-2089
2001200 CIF
Paper
C38 H33 Fe O2 P2P 18.684; 10.1; 10.109
71.55; 85.42; 73.97
808.3Shawkataly, O. B.; Khalil, H.; Fun, H.-K.; Chinnakali, K.; Teoh, S.-G.; Ito, Y.; Sawamura, M.
Structure of (<i>R</i>)-1-[(<i>S</i>)-1',2-bis(diphenylphosphino)ferrocenyl]ethyl acetate
Acta Crystallographica Section C, 1993, 49, 1898-1900
2001374 CIF
Paper
C21 H27 Cl O4 P2 PdP 18.9982; 9.1024; 16.774
88.285; 74.676; 63.459
1179.19Manojlović-Muir, L.; Cross, R. J.; Hoyle, R. W.
Structure of (η^5^-cyclopentadienyl)bis(dimethylphenylphosphine)palladium(II) perchlorate
Acta Crystallographica Section C, 1993, 49, 1603-1606
2001460 CIF
Paper
C28 H26 O6 SP 110.159; 13.533; 10.016
108.1; 102.92; 96.3
1251.6Kamei, S.; Sakai, Y.; Ohashi, Y.; Adachi, A.; Tanino, K.; Kuwajima, I.
Structure of an optically active anthracycline precursor
Acta Crystallographica Section C, 1993, 49, 1509-1511
2001540 CIF
Paper
C20 H14 Cl Fe N2 O2P 115.106; 13.57; 7.386
101.55; 94.18; 92.49
1476.8Elmali, A.; Elerman, Y.; Svoboda, I.; Fuess, H.
Structure of [<i>N</i>,<i>N</i>'-<i>o</i>-phenylenebis(salicylideneaminato)]iron(III) chloride as a five-coordinate monomer
Acta Crystallographica Section C, 1993, 49, 1365-1367
2002296 CIFAl2 O4 PbP 15.268; 8.458; 5.07
90; 118.78; 90
198Ploetz, K B; Mueller-Buschbaum, Hk
Synthese und Aufbau von Pb Al2 O4 und Pb Ga2 4
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1982, 488, 38-44
2002297 CIFGa2 O4 PbP 15.387; 8.575; 5.22
90; 118.99; 90
210.9Ploetz, K B; Mueller-Buschbaum, Hk
Synthese und Aufbau von Pb Al2 O4 und Pb Ga2 4
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1982, 488, 38-44
2002403 CIFCu2 O4 WP 17.9018; 8.2008; 5.8718
96.506; 94.033; 110.27
352.2Mumm, H C; Mueller-Buschbaum, Hk
Zur Kristallstruktur von Cu2 W O4
Journal of the Less-Common Metals, 1988, 142, 85-90
2002526 CIFCu O8 W2 YP 15.939; 6.042; 5.025
112.3; 92.84; 111.77
151.1Mueller-Buschbaum, Hk; Krueger, T
Ein Beitrag zur Kristallstruktur von Cu Y W2 O8, Cu Ho W2 O8 und Cu Yb W2 O8
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1992, 607, 52-56
2002544 CIFBi Cu O8 W2P 16.074; 6.083; 5.006
112.45; 91.86; 110.28
157.4Krüger, T. F.; Müller-Buschbaum, Hk.
Ein mit β-CuNdW~2~O~8~ und β-LiYbW~2~O~8~ verwandtes Kupfer-Wismut-Oxowolframat: CuBiW~2~O~8~
Journal of Alloys and Compounds, 1992, 190, L1-L3
2002735 CIFFe3 Na O12 V3P 16.757; 8.155; 9.816
106.053; 104.401; 102.093
480.4Martin, F-D; Mueller-Buschbaum, Hk
Eine synthetische Spezies zum Mineral Howardevansit mit Eisen anstelle von Kupfer: Na Fe3 V3 O12
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 1995, 50, 51-55
2003000 CIF
Paper
C19 H18 O4P 18.075; 8.871; 11.606
72.69; 80.07; 71.84
751.3Walker, Martina; Pohl, Ehmke; Herbst-Irmer, Regine; Gerlitz, Martin; Rohr, Jürgen; Sheldrick, George M.
Absolute configurations of Emycin D, E and F; mimicry of centrosymmetric space groups by mixtures of chiral stereoisomers
Acta Crystallographica Section B, 1999, 55, 607-616
2003002 CIF
Paper
C26 H19 Br O5P 18.279; 11.539; 11.962
101.32; 110.25; 92.76
1042.9Walker, Martina; Pohl, Ehmke; Herbst-Irmer, Regine; Gerlitz, Martin; Rohr, Jürgen; Sheldrick, George M.
Absolute configurations of Emycin D, E and F; mimicry of centrosymmetric space groups by mixtures of chiral stereoisomers
Acta Crystallographica Section B, 1999, 55, 607-616
2003056 CIF
Paper
C14 H27 Co N10 O2P 17.635; 8.202; 9.442
109.08; 103.46; 107.03
497.7Steve C.F. Au-Yeung
Crystal structures of [18]aneN~6~H~2~K[Co(CN)~6~].4H~2~O, [16]aneN~4~H~2~K[Co(CN)~6~] and [12]aneN~4~H~3~[Co(CN)~6~].2H~2~O. Insight into the electrostatic and hydrogen-bonding interaction in self-assembling supercomplexes
Acta Crystallographica Section B, 1999, 55, 389-395
2003104 CIF
Paper
C12 H26 N2 O4P 15.1933; 5.4064; 13.6968
91.516; 98.603; 110.376
355.16Dalhus, Bjørn; Görbitz, Carl Henrik
Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series
Acta Crystallographica Section B, 1999, 55, 424-431
2003168 CIFC48 H38 Cl4 F6 Mn N5 O5 P6P 110.563; 10.603; 12.25
97.68; 99.34; 93.11
1337.6Carriedo, Gabino A.; Fernández, Lucia; Gómez, Paloma; Garcia-Granda, Santiago; Velázquez, Amador Menéndez
cis-trans-[{N~3~P~3~Cl~4~(C~6~H~5~)(PPh~2~)}Mn(CO)~2~(bipy) {P(OPh)~3~}]PF~6~. A Cationic Manganese‒Carbonyl Complex with a Phosphazenylphosphine Ligand
Acta Crystallographica, Section C: Crystal Structure Communications, 1995, 51, 20-23
2003296 CIF
Paper
C22 H23 Cl N2 O3P 16.7639; 8.0105; 9.3111
95.703; 106.774; 92.499
479.254Schollmeyer, D.; Keilhofer, D.; Pindur, U.
Diels‒Alder Products of the Alkaloid ({-})-Thebaine with α-Chloroacrylnitrile and 1-Methoxy-1,3-cyclohexadiene with Tetracyanoethene
Acta Crystallographica Section C, 1995, 51, 502-505
2003461 CIF
Paper
C20 H26 O2P 110.568; 10.622; 8.545
106.39; 107.5; 83.38
877.1Fortes, A. G.; Johnstone, R. A. W.; Whittaker, D.; Lewis, N. J.
Fortesyl 2-Phenylpropionate. An Example of a Novel Hydrocarbon Skeleton Containing Three Fused Five-Membered Rings
Acta Crystallographica Section C, 1995, 51, 914-916
2003508 CIF
Paper
C12 H28 O14P 19.4; 11.029; 9.153
96.144; 96.84; 65.235
853.79Linden, A.; Lee, C. K.
α,α-<i>allo</i>-Trehalose Trihydrate
Acta Crystallographica Section C, 1995, 51, 1007-1012
2003516 CIF
Paper
C5 H18 N Na O9P 16.116; 16.656; 6.007
99.29; 100.94; 99.05
581.7Kashiwagi, T.; Sano, C.; Kawakita, T.; Nagashima, N.
Monosodium <small>L</small>-Glutamate Pentahydrate
Acta Crystallographica Section C, 1995, 51, 1053-1056
2003543 CIF
Paper
C18 H29 N O7P 110.232; 14.964; 6.826
93.81; 98.02; 104.37
997Parvez, M.; Benn, M. H.
Senecivernine Dihydrate
Acta Crystallographica Section C, 1995, 51, 1202-1204
2003587 CIF
Paper
C26 H31 F6 N2 O2 P PdP 19.1706; 9.3871; 9.5577
112.988; 113.552; 93.402
671.3Zehnder, M.; Neuburger, M.; von Matt, P.; Pfaltz, A.
(Allyl)palladium(II) Complexes with Chiral Ligands. I. (Allyl)palladium(II) Complexes with Methylenebis(oxazoline) Ligands
Acta Crystallographica Section C, 1995, 51, 1109-1112
2003597 CIF
Paper
C29 H33 F7 O5P 130.912; 7.719; 6.184
95.4; 87.16; 94.85
1462.5Kromm, P.; Allouchi, H.; Bideau, J.-P.; Cotrait, M.; Nguyen, H. T.
A Mesogenic Perfluorinated Compound
Acta Crystallographica Section C, 1995, 51, 1229-1231
2003673 CIF
Paper
C6 H8 O4P 14.558; 4.747; 8.15
76.92; 75.61; 82.17
165.78Fun, H.-K.; Sivakumar, K.; Ang, H.-B.; Sam, T.-W.; Gan, E.-K.
2,3-Dideoxy-<small>D</small>-<i>erythro</i>-hex-2-enono-1,5-lactone and 1,4-Lactone Obtained from Tri-<i>O</i>-acetyl-<small>D</small>-glucal
Acta Crystallographica Section C, 1995, 51, 1330-1333
2003825 CIF
Paper
C15 H16 Cu N4 O7P 17.624; 10.027; 12.001
97.46; 106.79; 108.76
806.2Moreno-Esparza, R.; Molins, E.; Briansó-Penalva, J. L.; Ruiz-Ramírez, L.; Redón, R.
Aqua(1,10-phenanthroline)(<small>L</small>-serinato)copper(II) Nitrate
Acta Crystallographica Section C, 1995, 51, 1505-1508

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