Crystallography Open Database

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1502899 CIFC17 H16 Br N2 O6 SP 32 2 111.307; 11.307; 27.871
90; 90; 120		3085.9Jiang, Xianxing; Zhang, Gen; Fu, Dan; Cao, Yiming; Shen, Fangfang; Wang, Rui
Direct organocatalytic asymmetric aldol reaction of alpha-isothiocyanato imides to alpha-ketoesters under low ligand loading: a doubly stereocontrolled approach to cyclic thiocarbamates bearing chiral quaternary stereocenters.
Organic letters, 2010, 12, 1544-1547
1504279 CIFC15 H20 O2P 32 2 17.68; 7.68; 37.274
90; 90; 120		1904Magauer, Thomas; Mulzer, Johann; Tiefenbacher, Konrad
Total syntheses of (+)-echinopine A and B: determination of absolute stereochemistry.
Organic letters, 2009, 11, 5306-5309
1504998 CIFC34 H63 Cl N7 O20.5P 32 2 113.3413; 13.3413; 46.8389
90; 90; 120		7219.94Norris, Timothy; VanAlsten, John; Hubbs, Stephen; Ewing, Marcus; Cai, Weiling; Jorgensen, Matthew L.; Bordner, Jon; Jensen, Grace O.
Commercialization and Late-Stage Development of a Semisynthetic Antifungal API: Anidulafungin/d-Fructose (Eraxis)
Organic Process Research & Development, 2008, 12, 447
1505417 CIFC13 H22 O3P 32 2 19.8192; 9.8192; 24.526
90; 90; 120		2047.9Song, Zhenlei; Hsung, Richard P.
A formal total synthesis of (+)-zincophorin. Observation of an unusual urea-directed Stork-Crabtree hydrogenation.
Organic letters, 2007, 9, 2199-2202
1505579 CIFC23 H22 N4 O15P 32 2 112.3183; 12.3183; 29.975
90; 90; 120		3939König, Christian M; Harms, Klaus; Koert, Ulrich
Stereoselective synthesis of methyl 7-dihydro-trioxacarcinoside B.
Organic letters, 2007, 9, 4777-4779
1506186 CIFC26 H29 N O5P 32 2 112.794; 12.794; 24.424
90; 90; 120		3462.3Feldman, Ken S.; Karatjas, Andrew G.
Extending Pummerer reaction chemistry. Asymmetric synthesis of spirocyclic oxindoles via chiral indole-2-sulfoxides.
Organic letters, 2006, 8, 4137-4140
1506952 CIFC11 H17 Br O4P 32 2 17.208; 7.208; 42.0575
90; 90; 120		1892.36Bravo, Fernando; McDonald, Frank E.; Neiwert, Wade A.; Hardcastle, Kenneth I.
Alkene substituents for selective activation of endo-regioselective polyepoxide oxacyclizations.
Organic letters, 2004, 6, 4487-4489
1508566 CIFC20 H28 Cl3 N O6P 32 2 111.1313; 11.1313; 33.9045
90; 90; 120		3638.14Amagata, Taro; Xiao, Jing; Chen, Yi-Pei; Holsopple, Nicholas; Oliver, Allen G.; Gokey, Trevor; Guliaev, Anton B.; Minoura, Katsuhiko
Creation of an HDAC-Based Yeast Screening Method for Evaluation of Marine-Derived Actinomycetes: Discovery of Streptosetin A.
Journal of natural products, 2012, 75, 2193-2199
1509707 CIFAg2 Rb S4 SbP 32 2 16.63; 6.63; 16.7
90; 90; 120		635.732Schimek, G.L.; Kolis, J.W.; Wood, P.T.; Pennington, W.T.
Supercritical ammonia synthesis and characterization of four new alkali metal silver antimony sulfides: M Ag2 Sb S4 and M2 Ag Sb S4 (M= K, Rb)
Journal of Solid State Chemistry, 1996, 123, 277-284
1511443 CIFB Ba O5 PP 32 2 17.114; 7.114; 6.993
90; 90; 120		306.494Dimitrova, O.V.; Pushcharovskii, D.Yu.; Gobechiya, E.R.; Pasero, M.; Merlino, S.
Hydrothermal synthesis and crystal structures of (Li, Ba)- nanoborate, Li Ba B9 O15, and Ba-borophosphate, Ba B P O5
Journal of Alloys Compd., 2002, 339, 70-75
1511444 CIFB Ba O5 PP 32 2 17.1329; 7.1329; 7.0368
90; 90; 120		310.055Du Chenxia; Wu Xicheng; Pan Shilie; Fu Peizhen; Chen Chuangyan; Zhang Guochun
Study on the growth, structure of nonlinear optical crystal Ba B P O5
Rengong Jingti Xuebao, 2003, 32, 281-285
1513030 CIFC24 H22 Cd N4 O4P 32 2 112.1793; 12.1793; 26.9353
90; 90; 120		3460.2Jens Hunger
Synthesis and structure of coordination polymers of Mn2+, Cu2+, Ag+, Zn2+ and Cd2+ by combination of bipyrazole and diphenate ligands
Inorganica Chimica Acta, 2013, 397, 60-68
1517229 CIFC20 H32 O3P 32 2 117.4587; 17.4587; 10.7319
90; 90; 120		2832.9Clark, J. Stephen; Delion, Laetitia; Farrugia, Louis J.
Total synthesis of the purported structure of sclerophytin f.
Organic letters, 2014, 16, 4300-4303
1521020 CIFAs F9 Xe2P 32 2 18.602; 8.602; 10.665
90; 90; 120		683.424Fir, B.A.; Schrobilgen, G.J.D.; Pointner, B.E.; Mercier, H.P.A.; Gerken, M.; Dixon, D.A.
An X-ray crystallographic study of (Xe2 F3) (Sb F6) and dimorphism in (Xe2 F3) (As F6): and a density functional theory study of the (Xe2 F3)(+) cation
Journal of Fluorine Chemistry, 2000, 105, 159-167
1529077 CIFC113.3 H88.95 Cl2 Cu2 F24 N15.65 O14 S2P 32 2 129.93; 29.93; 28.878
90; 90; 120		22403Mortezaei, Shahab; Catarineu, Noelle R.; Duan, Xueyou; Hu, Chunhua; Canary, James W.
Redox-configurable ambidextrous catalysis: structural and mechanistic insight
Chem. Sci., 2015, 6, 5904
1529316 CIFC70 H79 Co2 N9 O4P 32 2 114.064; 14.064; 27.143
90; 90; 120		4649.5Villanueva, Omar; Weldy, Nina Mace; Blakey, Simon B.; MacBeth, Cora E.
Cobalt catalyzed sp3C‒H amination utilizing aryl azides
Chem. Sci., 2015, 6, 6672
1529859 CIFC24 H17 Br F3 N O4P 32 2 112.075; 12.075; 26.601
90; 90; 120		3358.9Zhu, Yuanyuan; Li, Xiaoyuan; Chen, Qiao; Su, Jinhuan; Jia, Fengjing; Qiu, Shuai; Ma, Mingxia; Sun, Quantao; Yan, Wenjin; Wang, Kairong; Wang, Rui
Highly Enantioselective Cascade Reaction Catalyzed by Squaramides: the Synthesis of CF3-Containing Chromanes.
Organic letters, 2015, 17, 3826-3829
1531847 CIFCa Ir2 P2P 32 2 16.61; 6.61; 7.031
90; 90; 120		266.042Loehken, A.; Mewis, A.; Johrendt, D.; Lux, C.
Kristall- und elektronische Strukturen von A Ir2 P2 (A: Ca - Ba)
Zeitschrift fuer Anorganische und Allgemeine Chemie, 2002, 628, 1472-1476
1532512 CIFO2 SiP 32 2 14.8915; 4.8915; 5.3885
90; 90; 120		111.656Kroll, P.; Milko, M.
Theoretical investigation of the solid state reaction of silicon nitride and silicon dioxide forming silicon oxynitride (Si2 N2 O) under pressure
Zeitschrift fuer Anorganische und Allgemeine Chemie, 2003, 629, 1737-1750
1535066 CIFO2 SiP 32 2 15.02; 5.02; 5.56
90; 90; 120		121.342Massidda, S.; Continenza, A.; Freeman, A.J.; de Pascale, T.M.; Meloni, F.; Serra, M.
Interatomic potentials and the structural properties of silicon dioxide under pressure
Physical Review, Serie 3. B - Condensed Matter (18,1978-), 1990, 41, 10866-10869
1536406 CIFO2 SiP 32 2 15.0837; 5.0837; 5.4955
90; 90; 120		122.998Di Pompinio, A.; Continenza, A.
Structural properties of alpha-quartz under high pressure and amorphization effects
Physical Review, Serie 3. B - Condensed Matter (18,1978-), 1993, 48, 12558-12565
1536409 CIFO2 SiP 32 2 14.5404; 4.5404; 5.1761
90; 90; 120		92.411Di Pompinio, A.; Continenza, A.
Structural properties of alpha-quartz under high pressure and amorphization effects
Physical Review, Serie 3. B - Condensed Matter (18,1978-), 1993, 48, 12558-12565
1537251 CIFH24 K2 Mo12 O51 SiP 32 2 118.9915; 18.9915; 12.5935
90; 90; 120		3933.65Gao, S.; Cao, R.; Bi, W.; Lin, Z.; Li, X.
Porous structures constructed from [Si Mo12 O40] and [Si W12 O40] Keggin units
Microporous and Mesoporous Materials, 2005, 80, 139-145
1537254 CIFH16 K2 Na2 O48 Si W12P 32 2 118.93; 18.93; 12.491
90; 90; 120		3876.4Gao, S.; Lin, Z.; Cao, R.; Bi, W.; Li, X.
Porous structures constructed from [Si Mo12 O40] and [Si W12 O40] Keggin units
Microporous and Mesoporous Materials, 2005, 80, 139-145
1537351 CIFS8 V7P 32 2 16.706; 6.706; 17.412
90; 90; 120		678.12Groenvold, F.; Pedersen, B.; Haraldsen, H.; Tufte, T.
X-Ray and Magnetic Study of Vanadium Sulfides in the Range V5 S4 to V5 S8
Revue de Chimie Minerale, 1969, 6, 215-240
1538064 CIFO2 SiP 32 2 14.91304; 4.91304; 5.40463
90; 90; 120		112.979Hanic, F.; Sumichrast, L.
Alpha-beta phase transition in quartz
Silikaty, 1974, 18, 1-9
1544367 CIFC19 H20.24 Cl2 Co N4 O0.12P 32 2 19.044; 9.044; 40.737
90; 90; 120		2885.6Wang, Junfei; Li, Chao; Zhou, Qianxiong; Wang, Weibo; Hou, Yuanjun; Zhang, Baowen; Wang, Xuesong
A polypyridyl Co(ii) complex-based water reduction catalyst with double H2 evolution sites
Catal. Sci. Technol., 2016, 6, 8482
1544488 CIFC25 H36 O9P 32 2 118.458; 18.458; 28.8647
90; 90; 120		8516.61Liu, Qing-Xin; Yang, Yong-Xun; Zhang, Jian-Ping; Chen, Li-Ping; Shen, Yun-Heng; Li, Hui-Liang; Zhang, Wei-Dong
Isolation, Structure Elucidation, and Absolute Configuration of Highly Oxygenated Germacranolides from Carpesium cernuum.
Journal of natural products, 2016, 79, 2479-2486
1544491 CIFC25 H36 O9P 32 2 118.4959; 18.4959; 28.8516
90; 90; 120		8547.7Liu, Qing-Xin; Yang, Yong-Xun; Zhang, Jian-Ping; Chen, Li-Ping; Shen, Yun-Heng; Li, Hui-Liang; Zhang, Wei-Dong
Isolation, Structure Elucidation, and Absolute Configuration of Highly Oxygenated Germacranolides from Carpesium cernuum.
Journal of natural products, 2016, 79, 2479-2486
1546080 CIFC56 H48 Br6 Fe2 N8 O16 Zn3P 32 2 112.8153; 12.8153; 38.817
90; 90; 120		5520.9Brechin, Euan K.; Sanz, Sergio; O'Connor, Helen; Martí-Centelles, Vicente; Comar, Priyanka; Pitak, Mateusz; Coles, Simon; Lorusso, Giulia; Palacios, Elias; Evangelisti, Marco; Baldansuren, Amgalanbaatar; Chilton, Nicholas F.; Weihe, Høgni; McInnes, Eric J. L.; Lusby, Paul; Piligkos, Stergios
[MIII2MII3]n+ trigonal bipyramidal cages based on diamagnetic and paramagnetic metalloligands.
Chem. Sci., 2017
1546081 CIFC56 H48 Br6 Cr2 N6 O14 Zn3P 32 2 113.2429; 13.2429; 38.38
90; 90; 120		5829.1Brechin, Euan K.; Sanz, Sergio; O'Connor, Helen; Martí-Centelles, Vicente; Comar, Priyanka; Pitak, Mateusz; Coles, Simon; Lorusso, Giulia; Palacios, Elias; Evangelisti, Marco; Baldansuren, Amgalanbaatar; Chilton, Nicholas F.; Weihe, Høgni; McInnes, Eric J. L.; Lusby, Paul; Piligkos, Stergios
[MIII2MII3]n+ trigonal bipyramidal cages based on diamagnetic and paramagnetic metalloligands.
Chem. Sci., 2017
1546082 CIFC54 H48 Cl6 Co3 Fe2 N6 O12P 32 2 112.7708; 12.7708; 39.0709
90; 90; 120		5518.5Brechin, Euan K.; Sanz, Sergio; O'Connor, Helen; Martí-Centelles, Vicente; Comar, Priyanka; Pitak, Mateusz; Coles, Simon; Lorusso, Giulia; Palacios, Elias; Evangelisti, Marco; Baldansuren, Amgalanbaatar; Chilton, Nicholas F.; Weihe, Høgni; McInnes, Eric J. L.; Lusby, Paul; Piligkos, Stergios
[MIII2MII3]n+ trigonal bipyramidal cages based on diamagnetic and paramagnetic metalloligands.
Chem. Sci., 2017
1546099 CIFC20 H36 O11P 32 2 117.1874; 17.1874; 42.085
90; 90; 120		10766.6Zhou, Lei; Tuo, Yali; Hao, Yi; Guo, Xiaoman; Tang, Wei; Xue, Yongbo; Zeng, Junfen; Zhou, Yu; Xiang, Ming; Zuo, Jianping; Yao, Guangmin; Zhang, Yonghui
Cinnamomols A and B, Immunostimulative Diterpenoids with a New Carbon Skeleton from the Leaves of Cinnamomum cassia.
Organic letters, 2017, 19, 3029-3032
1551357 CIFC24 H32 F12 Mn N6 Sb2P 32 2 110.5506; 10.5506; 25.221
90; 90; 120		2431.35Jinpeng Zhao; Takeshi Nanjo; Emilio C. de Lucca Jr; M. Christina White
Chemoselective methylene oxidation in aromatic molecules
Nature Chemistry, 2019, 11, 213-221
1552560 CIFC10 H13 F N2 O5P 32 2 16.6465; 6.6465; 43.3632
90; 90; 120		1658.97Yoon, Ji-Seong; Kim, Gyudong; Jarhad, Dnyandev B.; Kim, Hong-Rae; Shin, Young-Sup; Qu, Shuhao; Sahu, Pramod K.; Kim, Hea Ok; Lee, Hyuk Woo; Wang, Su Bin; Kong, Yun Jeong; Chang, Tong-Shin; Ogando, Natacha S.; Kovacikova, Kristina; Snijder, Eric J.; Posthuma, Clara C.; van Hemert, Martijn J.; Jeong, Lak Shin
Design, Synthesis, and Anti-RNA Virus Activity of 6'-Fluorinated-Aristeromycin Analogues.
Journal of medicinal chemistry, 2019, 62, 6346-6362
1553399 CIFC25 H28 O9P 32 2 111.686; 11.686; 29.8596
90; 90; 120		3531.4Arunrattiyakorn, Panarat; Kuno, Mayuso; Aree, Thammarat; Laphookhieo, Surat; Sriyatep, Teerayut; Kanzaki, Hiroshi; Garcia Chavez, Miguel Angel; Wang, Yan Alexander; Andersen, Raymond J.
Biotransformation of β-Mangostin by an Endophytic Fungus of Garcinia mangostana to Furnish Xanthenes with an Unprecedented Heterocyclic Skeleton.
Journal of natural products, 2018, 81, 2244-2250
1554046 CIFC53 H47 N O6P 32 2 111.549; 11.549; 27.874
90; 90; 120		3220Pitrat, Delphine; Daugey, Nicolas; Jean, Marion; Vanthuyne, Nicolas; Wien, Frank; Ducasse, Laurent; Calin, Nathalie; Buffeteau, Thierry; Brotin, Thierry
Unusual Chiroptical Properties of the Cryptophane-222 Skeleton.
The journal of physical chemistry. B, 2016, 120, 12650-12659
1555005 CIFC28 H32 N4 O2P 32 2 111.32263; 11.32263; 35.383
90; 90; 120		3928.44Davies, 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
1555272 CIFC18 H12 O20P 32 2 116.523; 16.523; 19.4
90; 90; 120		4586.8Cui, Peng; McMahon, David P.; Spackman, Peter R.; Alston, Ben M.; Little, Marc A.; Day, Graeme M.; Cooper, Andrew I.
Mining predicted crystal structure landscapes with high throughput crystallisation: old molecules, new insights
Chemical Science, 2019, 10, 9988
1556008 CIFC29.5 H29 Cl N2 O3 SP 32 2 118.4813; 18.4813; 16.4257
90; 90; 120		4858.7Halli, Juliette; Bolte, Michael; Bats, Jan; Manolikakes, Georg
Modular Two-Step Approach for the Stereodivergent Synthesis of 1,3-Diamines with Three Continuous Stereocenters.
Organic letters, 2017, 19, 674-677
1557233 CIFS8 V7P 32 2 16.689; 6.689; 17.403
90; 90; 120		674.3Bindi,; Zaccarini,; Ifandi,; Tsikouras,; Stanley,; Garuti,; Mauro,
Grammatikopoulosite, NiVP, a New Phosphide from the Chromitite of the Othrys Ophiolite, Greece
Minerals, 2020, 10, 131
1557744 CIFS8 V7P 32 2 16.689; 6.689; 17.403
90; 90; 120		674.3Bindi, Luca; Zaccarini, Federica; Bonazzi, Paola; Grammatikopoulos, Tassos; Tsikouras, Basilios; Stanley, Chris; Garuti, Giorgio
Eliopoulosite, V7S8, A New Sulfide from the Podiform Chromitite of the Othrys Ophiolite, Greece
Minerals, 2020, 10, 245
1559678 CIFC20 H22 Cd N4 O12P 32 2 114.8922; 14.8922; 12.7663
90; 90; 120		2452Watkins, Daniel; Roseveare, Thomas M.; Warren, Mark R.; Thompson, Stephen P.; Fletcher, Ashleigh J.; Brammer, Lee
Multi-stimulus linear negative expansion of a breathing M(O<sub>2</sub>CR)<sub>4</sub>-node MOF.
Faraday discussions, 2021, 225, 133-151
1559680 CIFC20 H22 Cd N4 O12P 32 2 115.0465; 15.0465; 12.6619
90; 90; 120		2482.56Watkins, Daniel; Roseveare, Thomas M.; Warren, Mark R.; Thompson, Stephen P.; Fletcher, Ashleigh J.; Brammer, Lee
Multi-stimulus linear negative expansion of a breathing M(O<sub>2</sub>CR)<sub>4</sub>-node MOF.
Faraday discussions, 2021, 225, 133-151
1560527 CIFC40 H52 B20P 32 2 111.3287; 11.3287; 29.3678
90; 90; 120		3264.1Zhang, Jie; Xie, Zuowei
Tandem [4 + 2]/[2 + 2] cycloaddition of o-carboryne with enynes: facile construction of carborane-fused tricyclics
Chemical Science, 2021, 12, 5616-5620
1561684 CIFC27 H9 Co3 O18P 32 2 118.5696; 18.5696; 12.0128
90; 90; 120		3587.4Yu, Xianglin; Toh, Yong Siang; Zhao, Jun; Nie, Lina; Ye, Kaiqi; Wang, Yue; Li, Dongsheng; Zhang, Qichun
Surfactant-thermal method to prepare two new cobalt metal-organic frameworks
Journal of Solid State Chemistry, 2015, 232, 14-18
1562010 CIFC182.67 H102 O60 P3 Zr9P 32 2 145.122; 45.122; 49.238
90; 90; 120		86818Gong, Wei; Liu, Yan; Cui, Yong
Chiral and robust Zr(IV)-based metal-organic frameworks built from spiro skeletons.
Faraday discussions, 2021, 231, 168-180
1564151 CIFC52 H60 N4 O4 S2 Zn2P 32 2 111.5916; 11.5916; 34.5612
90; 90; 120		4021.67Zhao, Hongyan; Zhang, Shaohui; Fang, Xiaojun; Chen, Liang; Ren, Wenshan
Synthesis, structure and catalytic activity of organozinc complexes derived from chiral sulfonylamidoazetidines
Inorganica Chimica Acta, 2020, 511, 119767
1564799 CIFC23 H33 Cl O5P 32 2 111.4588; 11.4588; 28.4455
90; 90; 120		3234.61Luo, 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
1566004 CIFC32.5 H58.5 B1.5 Na O8 TbP 32 2 113.8128; 13.8128; 33.7
90; 90; 120		5568.3Bardonov, Daniil A.; Komarov, Pavel D.; Sadrtdinova, Guzelia I.; Besprozvannyh, Viktoria K.; Lyssenko, Konstantin A.; Gudovannyy, Alexei O.; Nifant'ev, Ilya E.; Minyaev, Mikhail E.; Roitershtein, Dmitrii M.
Cyclopentadienyl lanthanide borohydrides derived from the unsubstituted cyclopentadienyl ligand. Unprecedented structural diversity and ε-caprolactone polymerization
Inorganica Chimica Acta, 2022, 529, 120638
1566397 CIFC42 H34 F12 Fe N14 P2 S4P 32 2 114.8052; 14.8052; 19.695
90; 90; 120		3738.7Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane
Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials
Chemical Science, 2022
1571164 CIF
Paper		C6 H17 Br3 N2 OP 32 2 19.5838; 9.5838; 23.227
90; 90; 120		1847.56Budzianowski, Armand; Petřiček, Vaclav; Katrusiak, Andrzej
Metal-free enantiomorphic perovskite [dabcoH<sub>2</sub>]<sup>2+</sup>[H<sub>3</sub>O]<sup>+</sup>Br<sup>-</sup> <sub>3</sub> and its one-dimensional polar polymorph.
IUCrJ, 2022, 9, 544-550
1571445 CIFC2.571 H4.146 Cu0.143 N0.857 OP 32 2 110.9067; 10.9067; 31.97
90; 90; 120		3293.5Maniappan, Sonia; Dutta, Camelia; Cheran, Arunima; Solís, Diego M.; Kumar, Jatish
Engineering copper plasmonic chirality via ligand-induced dissolution for enantioselective recognition of amino acids
Chemical Science, 2024
2000936 CIF
Paper		C8 H16 N2 O4P 32 2 19.437; 9.437; 10.69
90; 90; 120		824.47Rychlewska, U.
Unusual conformation of (<i>R</i>,<i>R</i>)-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethyltartramide (I) and its <i>O</i>,<i>O</i>'-dibenzoyl derivative (II)
Acta Crystallographica Section C, 1992, 48, 965-969
2001920 CIF
Paper		C12 H30 O15P 32 2 18.789; 8.789; 21.245
90; 90; 120		1421.2Lee, C.-K.; Koh, L. L.
Structure of β,β-trehalose
Acta Crystallographica Section C, 1993, 49, 621-624
2002039 CIF
Paper		C14 H25 N O5P 32 2 111.831; 11.831; 19.948
90; 90; 120		2418.1Gallagher, T.; Giles, M. E.; Mahon, M. F.; Molloy, K. C.; Hadley, M. S.
Structure of 1,2,4-trideoxy-1,4-imino-3,5;6,7-di-<i>O</i>-isopropylidene-<small>L</small>-<i>glycero</i>-<small>D</small>-<i>gluco</i>-octitol: a key intermediate in the enantioselective synthesis of 8-epicastanospermine
Acta Crystallographica Section C, 1993, 49, 40-42
2002576 CIFHg O2 SrP 32 2 13.833; 3.833; 18.98999
90; 90; 120		241.6Soll, M; Mueller-Buschbaum, Hk
Sr Hg O2: ein Oxomercurate mit Delafossitstruktur
Journal of the Less-Common Metals, 1991, 175, 295-299
2002733 CIFCr Hg3 O6P 32 2 17.137; 7.137; 10.017
90; 90; 120		441.9Hansen, T; Mueller-Buschbaum, Hk; Walz, L
Einkristallroentgenstrukturanalyse an Quecksilberchromat(VI): Hg3 O2 Cr O4
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 1995, 50, 47-50
2004102 CIF
Paper		Ce H2 Na O9 S2P 32 2 17.019; 7.019; 12.925
90; 90; 120		551.46Blackburn, A. C.; Gerkin, R. E.
Redetermination of Sodium Cerium(III) Sulfate Monohydrate, NaCe(SO~4~)~2~.H~2~O
Acta Crystallographica Section C, 1995, 51, 2215-2218
2004545 CIF
Paper		C34 H28 O4P 32 2 19.691; 9.691; 24.841
90; 90; 120		2020.4Hibbs, D. E.; Hursthouse, M. B.; Malik, K. M. A.; Ward, R. S.; Pelter, A.; Aalberg, L.
2,3,10,11-Tetraphenyl-1,4,9,12-tetraoxadispiro[4.2.4.2]tetradeca-6,13-diene
Acta Crystallographica Section C, 1996, 52, 379-381
2010041 CIF
Paper		C10 H8 F6 N4P 32 2 19.48; 9.48; 24.792
90; 90; 120		1929.6Abdul-Ghani, Mohamad; Beagley, Brian; Pritchard, Robin G.; Tipping, Anthony E.
(<i>Z</i>,<i>Z</i>)-5-Anilino-1,1,1,6,6,6-hexafluoro-3,4-diazahexa-2,4-diene-2-amine
Acta Crystallographica Section C, 1994, 50, 1492-1494
2013672 CIF
HKL
Paper		C20 H30 N2 O3 S2P 32 2 18.851; 8.851; 44.886
90; 90; 120		3045.27Jegorov, Alexandr; Horák, Zdeněk; Čejka, Jan; Kratochvíl, Bohumil; Císařová, Ivana
Pergolide mesylate form II
Acta Crystallographica Section C, 2003, 59, o575-o576
2015448 CIF
HKL
Paper		C9 H12 N6 O4P 32 2 19.7859; 9.7859; 20.3813
90; 90; 120		1690.3Lin, Wen-Qing; Ming, Xin; Eickmeier, Henning; Seela, Frank
7-Deaza-2,8-diazaadenosine
Acta Crystallographica Section C, 2006, 62, o379-o381
2017432 CIF
HKL
Paper		C26 H33 N O3.5 S2P 32 2 112.0797; 12.0797; 28.326
90; 90; 120		3579.5Goodreid, Jordan D.; Jennings, Michael C.; Tam, William
Asymmetric ruthenium-catalysed [2+2] cycloadditions between bicyclic alkenes and chiral aryl-substituted acetylenic acyl camphorsultam alkynes
Acta Crystallographica Section C, 2009, 65, o649-o652
2018446 CIF
HKL
Paper		C24 H52 Br NP 32 2 115.12762; 15.12762; 21.0223
90; 90; 120		4166.31Kelland, Malcolm A.; Thompson, Amber L.
Alkyl-chain disorder in tetraisohexylammonium bromide
Acta Crystallographica Section C, 2012, 68, o152-o155
2018447 CIF
HKL
Paper		C24 H52 Br NP 32 2 115.4995; 15.4995; 21.1346
90; 90; 120		4397.04Kelland, Malcolm A.; Thompson, Amber L.
Alkyl-chain disorder in tetraisohexylammonium bromide
Acta Crystallographica Section C, 2012, 68, o152-o155
2018448 CIF
HKL
Paper		C24 H52 Br NP 32 2 115.1327; 15.1327; 20.9326
90; 90; 120		4151.32Kelland, Malcolm A.; Thompson, Amber L.
Alkyl-chain disorder in tetraisohexylammonium bromide
Acta Crystallographica Section C, 2012, 68, o152-o155
2020169 CIFCa Cd H8 N4 O12P 32 2 17.5003; 7.5003; 18.413
90; 90; 120		897.041Aoyama, T.; Saito, Y.; Ohba, S.
Structures of cadmium magnesium tetranitrite dihydrate, cadmiun calcium tetranitrite tetrahydrate and cadmium strontium tetranitrite tetrahydrate.
Acta Crystallographica C (39,1983-), 1988, 44, 1703-1707
2021065 CIF
HKL
Paper		C15 H14 OP 32 2 19.4796; 9.4796; 11.164
90; 90; 120		868.8Soqaka, Antonia A.; Esterhuysen, Catharine; Lemmerer, Andreas
Prevalent polymorphism in benzophenones
Acta Crystallographica Section C, 2018, 74
2022158 CIF
Paper		C22 H18 Cu N4 O2 S2P 32 2 19.794; 9.794; 19.8673
90; 90; 120		1650.4Deng, Qian-Jun; Chen, Min; Chen, Dong-Chu; Long, Hang-Yu; Chen, Chang-Ai
Tracking the dissolution‒recrystallization structural transformation (DRST) of copper(II) complexes: a combined crystallographic, mass spectrometric and DFT study
Acta Crystallographica Section C, 2020, 76
2100188 CIF
Paper		O2 SiP 32 2 14.91427; 4.91427; 5.4058
90; 90; 120		113.06Caspi, El'ad N.; Pokroy, Boaz; Lee, Peter L.; Quintana, John P.; Zolotoyabko, Emil
On the structure of aragonite
Acta Crystallographica Section B, 2005, 61, 129-132
2102861 CIF
Paper		C6 H12 O2P 32 2 110.183; 10.183; 10.796
90; 90; 120		969.49Lloyd, Michael A.; Patterson, Garth E.; Simpson, Greg H.; Duncan, Laura L.; King, Daniel P.; Fu, Yigang; Patrick, Brian O.; Parkin, Sean; Brock, Carolyn Pratt
Solid-state compounds of stereoisomers: <i>cis</i> and <i>trans</i> isomers of 1,2-cyclohexanediol and 2,3-tetralindiol
Acta Crystallographica Section B, 2007, 63, 433-447
2102862 CIF
Paper		C6 H12 O2P 32 2 110.229; 10.229; 10.909
90; 90; 120		988.51Lloyd, Michael A.; Patterson, Garth E.; Simpson, Greg H.; Duncan, Laura L.; King, Daniel P.; Fu, Yigang; Patrick, Brian O.; Parkin, Sean; Brock, Carolyn Pratt
Solid-state compounds of stereoisomers: <i>cis</i> and <i>trans</i> isomers of 1,2-cyclohexanediol and 2,3-tetralindiol
Acta Crystallographica Section B, 2007, 63, 433-447
2103347 CIF
Paper		C32 H46 O8 SP 32 2 19.971; 9.971; 28.304
90; 90; 120		2437Marsh, Richard E.
The space groups of point group <i>C</i>~3~: some corrections, some comments
Acta Crystallographica Section B, 2002, 58, 893-899
2103349 CIF
Paper		C18 H18 N2 Ni2 O9P 32 2 112.7701; 12.7701; 9.9409
90; 90; 120		1403.93Marsh, Richard E.
The space groups of point group <i>C</i>~3~: some corrections, some comments
Acta Crystallographica Section B, 2002, 58, 893-899
2103357 CIF
Paper		C2 H3 N2 PP 32 2 18.154; 8.154; 5.512
90; 90; 120		317.381Marsh, Richard E.
The space groups of point group <i>C</i>~3~: some corrections, some comments
Acta Crystallographica Section B, 2002, 58, 893-899
2103358 CIF
Paper		C2 H3 As N2P 32 2 18.1218; 8.1218; 5.8196
90; 90; 120		332.452Marsh, Richard E.
The space groups of point group <i>C</i>~3~: some corrections, some comments
Acta Crystallographica Section B, 2002, 58, 893-899
2103361 CIF
Paper		C5 H13 B N2P 32 2 17.373; 7.373; 10.878
90; 90; 120		512.116Marsh, Richard E.
The space groups of point group <i>C</i>~3~: some corrections, some comments
Acta Crystallographica Section B, 2002, 58, 893-899
2103364 CIF
Paper		C52 H58 F12 O12 P2 Rh2P 32 2 112.9751; 12.9751; 29.685
90; 90; 120		4328.02Marsh, Richard E.
The space groups of point group <i>C</i>~3~: some corrections, some comments
Acta Crystallographica Section B, 2002, 58, 893-899
2103367 CIF
Paper		C34 H54 N2 Ni2 Si4P 32 2 113.178; 13.178; 21.043
90; 90; 120		3164.74Marsh, Richard E.
The space groups of point group <i>C</i>~3~: some corrections, some comments
Acta Crystallographica Section B, 2002, 58, 893-899
2103370 CIF
Paper		C17 H24 N4 O3P 32 2 17.8645; 7.8645; 23.895
90; 90; 120		1279.91Marsh, Richard E.
The space groups of point group <i>C</i>~3~: some corrections, some comments
Acta Crystallographica Section B, 2002, 58, 893-899
2103372 CIF
Paper		C10 H7 Cr2 Cu N2 O10P 32 2 18.986; 8.986; 19.04
90; 90; 120		1331.47Marsh, Richard E.
The space groups of point group <i>C</i>~3~: some corrections, some comments
Acta Crystallographica Section B, 2002, 58, 893-899
2103374 CIF
Paper		C216 H180 Hg32 Se50P 32 2 122.753; 22.753; 53.02
90; 90; 120		23771Marsh, Richard E.
The space groups of point group <i>C</i>~3~: some corrections, some comments
Acta Crystallographica Section B, 2002, 58, 893-899
2103375 CIF
Paper		C22 H28 I O2 P2 VP 32 2 114.305; 14.305; 32.852
90; 90; 120		5821.95Marsh, Richard E.
The space groups of point group <i>C</i>~3~: some corrections, some comments
Acta Crystallographica Section B, 2002, 58, 893-899
2103376 CIF
Paper		C56 H42 N4 O9 Zn2P 32 2 19.865; 9.865; 44.179
90; 90; 120		3723.41Marsh, Richard E.
The space groups of point group <i>C</i>~3~: some corrections, some comments
Acta Crystallographica Section B, 2002, 58, 893-899
2103377 CIF
Paper		C37 H44 Cl Fe2 N2 O6 Pd2P 32 2 111.026; 11.026; 27.253
90; 90; 120		2869.33Marsh, Richard E.
The space groups of point group <i>C</i>~3~: some corrections, some comments
Acta Crystallographica Section B, 2002, 58, 893-899
2103381 CIF
Paper		C30.5 H47 O9.5P 32 2 112.115; 12.115; 36.851
90; 90; 120		4684.11Marsh, Richard E.
The space groups of point group <i>C</i>~3~: some corrections, some comments
Acta Crystallographica Section B, 2002, 58, 893-899
2103384 CIF
Paper		C50 H46 N5 O21 P4 PrP 32 2 115.71; 15.71; 40.067
90; 90; 120		8563.87Marsh, Richard E.
The space groups of point group <i>C</i>~3~: some corrections, some comments
Acta Crystallographica Section B, 2002, 58, 893-899
2104300 CIF
HKL
Paper		C44 H30 N2 O8P 32 2 111.873; 11.873; 43.046
90; 90; 120		5255.1Rychlewska, Urszula; Plutecka, Agnieszka; Hoffmann, Marcin; Skowronek, Paweł; Gawrońska, Krystyna; Gawroński, Jacek
Probing the shapes of chiral bis-(<i>o</i>-naphthalimidobenzoyl) systems using X-ray and circular dichroism methods
Acta Crystallographica Section B, 2009, 65, 86-95
2104972 CIF
HKL
Paper		Ca H1.25 O4.625 SeP 32 2 114.1681; 14.1681; 13.4241
90; 90; 120		2333.67Fritz, Susanne; Schmidt, Horst; Paschke, Iris; Magdysyuk, Oxana V.; Dinnebier, Robert E.; Freyer, Daniela; Voigt, Wolfgang
CaSeO~4~·0.625H~2~O ‒ water channel occupation in a bassanite related structure
Acta Crystallographica Section B, 2011, 67, 293-301
2104973 CIF
Paper		Ca H1.25 O4.625 SeP 32 2 114.1035; 14.1035; 13.3622
90; 90; 120		2301.8Fritz, Susanne; Schmidt, Horst; Paschke, Iris; Magdysyuk, Oxana V.; Dinnebier, Robert E.; Freyer, Daniela; Voigt, Wolfgang
CaSeO~4~·0.625H~2~O ‒ water channel occupation in a bassanite related structure
Acta Crystallographica Section B, 2011, 67, 293-301
2105041 CIF
Paper		Ca H1.25 O4.625 SP 32 2 113.869; 13.869; 12.7189
90; 90; 120		2118.7Schmidt, Horst; Paschke, Iris; Freyer, Daniela; Voigt, Wolfgang
Water channel structure of bassanite at high air humidity: crystal structure of CaSO~4~·0.625H~2~O
Acta Crystallographica Section B, 2011, 67, 467-475
2106355 CIFO2 SiP 32 2 14.765; 4.765; 5.296
90; 90; 120		104.137d'Amour, H.; Denner, W.; Schulz, H.
Structure determination of alpha-quartz up to 68*10exp8 Pa
Acta Crystallographica B (24,1968-38,1982), 1979, 35, 550-555
2108369 CIF
HKL		H4 N2 O3 WP 32 2 15.79842; 5.79842; 9.2341
90; 90; 120		268.871Giovannelli, F.; Mathieu, C.; Fritsch, K.; Adil, K.; Goutenoire, F.; Habicht, K.; Delorme, F.
Room-temperature synthesis of a new stable (N~2~H~4~)WO~3~ compound: a route for hydrazine trapping
Acta Crystallographica Section B, 2019, 75
2201499 CIF
HKL
Paper		C10 H18 N2 O5 S2P 32 2 15.3906; 5.3906; 40.964
90; 90; 120		1030.9Shi, Yun-Mei; Zhang, Wen-Qin
<i>S,S</i>'-(But-2-yne-1,4-diyl)bis(<small>L</small>-cysteine) monohydrate
Acta Crystallographica Section E, 2002, 58, o1455-o1457
2202292 CIF
HKL
Paper		Cl3 Cu H13 O18P 32 2 110.1659; 10.1659; 13.1601
90; 90; 120		1177.83Bramsen, Fabienne; Bond, Andrew D.; McKenzie, Christine J.
Hydronium pentaaquacopper(II) triperchlorate
Acta Crystallographica Section E, 2003, 59, i105-i106
2205391 CIF
HKL
Paper		C10 H12 N4 O6 S2P 32 2 111.0122; 11.0122; 18.8285
90; 90; 120		1977.4Liu, Bing-Xin; Xu, Duan-Jun
2,2'-Diamino-4,4'-bi-1,3-thiazolium (2<i>R</i>,3<i>R</i>)-tartrate
Acta Crystallographica Section E, 2005, 61, o753-o755
2209268 CIF
HKL
Paper		C32 H24 Br4 N4 O5 S2 ZnP 32 2 115.8969; 15.8969; 12.1289
90; 90; 120		2654.5Silva, Luiz Everson da; Joussef, Antonio Carlos; Foro, Sabine; Schmidt, Boris
Aquabis[<i>N</i>-(5,7-dibromoquinolin-8-yl)-4-methylbenzenesulfonamidato-κ^2^<i>N</i>,<i>N</i>']zinc(II)
Acta Crystallographica Section E, 2006, 62, m1258-m1259
2211922 CIF
HKL
Paper		C12 H12 N12 Ni O5P 32 2 112.406; 12.406; 12.211
90; 90; 120		1627.6Yun Ling; Hong-Yan Gao; Lei Zhang
[Bis(triazol-1-yl)acetato]nickel(II) monohydrate
Acta Crystallographica Section E, 2007, 63, m193-m195
2213623 CIF
HKL
Paper		C18 H9 I3 S3P 32 2 112.969; 12.969; 20.7
90; 90; 120		3015Zhu, Chen-Hao; Li, Wei-Jie; Kong, Lin
1,3,5-Tris(5-iodothiophen-2-yl)benzene
Acta Crystallographica Section E, 2007, 63, o2761-o2761
2217706 CIF
HKL
Paper		C17 H28 O5P 32 2 110.0253; 10.0253; 28.628
90; 90; 120		2491.8Jasinski, Jerry P.; Butcher, Ray J.; Yathirajan, H. S.; Narayana, B.; Sreevidya, T. V.
A second polymorph of β-arteether
Acta Crystallographica Section E, 2008, 64, o585-o586
2219249 CIF
HKL
Paper		C36 H28 P2 Pd S2P 32 2 19.306; 9.306; 30.069
90; 90; 120		2255.2Fierro-Arias, Jaime; Morales-Morales, David; Hernández-Ortega, Simón
<i>cis</i>-Bis[2-(diphenylphosphino)benzenethiolato-κ^2^<i>P</i>,<i>S</i>]palladium(II)
Acta Crystallographica Section E, 2008, 64, m1196
2222535 CIF
HKL
Paper		C6 H21 Br2 Mg N3P 32 2 19.0951; 9.0951; 14.4544
90; 90; 120		1035.49Vitze, Hannes; Lerner, Hans-Wolfram; Bolte, Michael
Dibromidotris(dimethylamine)magnesium(II)
Acta Crystallographica Section E, 2009, 65, m888
2236145 CIF
HKL
Paper		C24 H26 O2 Si2P 32 2 19.2241; 9.2241; 23.7787
90; 90; 120		1752.13Sparrow, Christopher R.; Fronczek, Frank R.; Watkins, Steven F.
1,2-Bis{2-[2-(trimethylsilyl)ethynyl]phenyl}ethane-1,2-dione
Acta Crystallographica Section E, 2012, 68, o2809
2240843 CIF
HKL
Paper		Pd6.69 Sn4.31P 32 2 18.77574; 8.77574; 16.9004
90; 90; 120		1127.18Klein, Wilhelm; Jin, Hanpeng; Hlukhyy, Viktor; Fässler, Thomas F.
`Pd~20~Sn~13~' revisited: crystal structure of Pd~6.69~Sn~4.31~
Acta Crystallographica Section E, 2015, 71, 807-809
2240849 CIF
HKL
Paper		C5 N6P 32 2 18.0746; 8.0746; 16.7315
90; 90; 120		944.73Parrish, Damon A.; Kramer, Stephanie; Windler, G. Kenneth; Chavez, David E.; Leonard, Philip W.
Crystal structure of 2-diazoimidazole-4,5-dicarbonitrile
Acta Crystallographica Section E, 2015, 71, o491
2300366 CIFGe0.97 O2 Si0.03P 32 2 14.983; 4.983; 5.6339
90; 90; 120		121.149Lignie, Adrien; Granier, Dominique; Armand, Pascale; Haines, Julien; Papet, Philippe
Modulation of quartz-like GeO~2~ structure by Si substitution: an X-ray diffraction study of Ge~1{-~<i>x</i>}Si<i>~x~</i>O~2~ (0 {łeq} <i>x</i> < 0.2) flux-grown single crystals
Journal of Applied Crystallography, 2012, 45, 272-278
2300368 CIF
HKL		Ge0.9 O2 Si0.1P 32 2 14.97517; 4.97517; 5.60565
90; 90; 120		120.163Lignie, Adrien; Granier, Dominique; Armand, Pascale; Haines, Julien; Papet, Philippe
Modulation of quartz-like GeO~2~ structure by Si substitution: an X-ray diffraction study of Ge~1{-~<i>x</i>}Si<i>~x~</i>O~2~ (0 {łeq} <i>x</i> < 0.2) flux-grown single crystals
Journal of Applied Crystallography, 2012, 45, 272-278
2300370 CIFO2 SiP 32 2 14.91636; 4.91636; 5.4084
90; 90; 120		113.211Lignie, Adrien; Granier, Dominique; Armand, Pascale; Haines, Julien; Papet, Philippe
Modulation of quartz-like GeO~2~ structure by Si substitution: an X-ray diffraction study of Ge~1{-~<i>x</i>}Si<i>~x~</i>O~2~ (0 {łeq} <i>x</i> < 0.2) flux-grown single crystals
Journal of Applied Crystallography, 2012, 45, 272-278
3000027 On hold until 2014-04-19B4 Dy Fe3 O12P 32 2 19.5298; 9.5298; 7.5461
90; 90; 120		593.5Tomoyasu Usui; Yoshikazu Tanaka; Hiroshi Nakajima; M. Taguchi; A. Chainani; M. Oura; S. Shin; Naoyuki Katayama; Hiroshi Sawa; Yusuke Wakabayashi; Tsuyoshi Kimura
Observation of quadrupole helix chirality and its domain structure in DyFe3(BO3)4
To be published
3000028 On hold until 2014-04-19B4 Dy Fe3 O12P 32 2 19.5337; 9.5337; 7.5516
90; 90; 120		594.42Tomoyasu Usui; Yoshikazu Tanaka; Hiroshi Nakajima; M. Taguchi; A. Chainani; M. Oura; S. Shin; Naoyuki Katayama; Hiroshi Sawa; Yusuke Wakabayashi; Tsuyoshi Kimura
Observation of quadrupole helix chirality and its domain structure in DyFe3(BO3)4
To be published
3000029 On hold until 2014-04-19B4 Dy Fe3 O12P 32 2 19.5266; 9.5266; 7.5471
90; 90; 120		593.18Tomoyasu Usui; Yoshikazu Tanaka; Hiroshi Nakajima; M. Taguchi; A. Chainani; M. Oura; S. Shin; Naoyuki Katayama; Hiroshi Sawa; Yusuke Wakabayashi; Tsuyoshi Kimura
Observation of quadrupole helix chirality and its domain structure in DyFe3(BO3)4
To be published
3000031 On hold until 2014-04-19B4 Dy Fe3 O12P 32 2 19.528; 9.528; 7.5462
90; 90; 120		593.28Tomoyasu Usui; Yoshikazu Tanaka; Hiroshi Nakajima; M. Taguchi; A. Chainani; M. Oura; S. Shin; Naoyuki Katayama; Hiroshi Sawa; Yusuke Wakabayashi; Tsuyoshi Kimura
Observation of quadrupole helix chirality and its domain structure in DyFe3(BO3)4
To be published
4000500 CIFGd H2 Na O9 S2P 32 2 16.8816; 6.8816; 12.7702
90; 90; 120		523.73Josefina Perles; Carlos Fortes-Revilla; Enrique Gutiérrez-Puebla; Marta Iglesias; M. Ángeles Monge; Caridad Ruiz-Valero; Natalia Snejko
Synthesis, Structure, and Catalytic Properties of Rare-Earth Ternary Sulfates
Chemistry of Materials, 2005, 17, 2701-2706
4001621 CIFC73 H57 Br2 Cl9 Cu2 N2 P4P 32 2 118.5561; 18.5561; 21.2628
90; 90; 120		6340.5Tan, Xin; Li, Lei; Zhang, Jianyong; Han, Xiaorui; Jiang, Long; Li, Fuwei; Su, Cheng-Yong
Three-Dimensional Phosphine Metal‒Organic Frameworks Assembled from Cu(I) and Pyridyl Diphosphine
Chemistry of Materials, 2012, 24, 480
4001622 CIFC37 H29 Cl7 Cu N P2P 32 2 118.41; 18.41; 21.321
90; 90; 120		6258Tan, Xin; Li, Lei; Zhang, Jianyong; Han, Xiaorui; Jiang, Long; Li, Fuwei; Su, Cheng-Yong
Three-Dimensional Phosphine Metal‒Organic Frameworks Assembled from Cu(I) and Pyridyl Diphosphine
Chemistry of Materials, 2012, 24, 480
4001747 CIFB O5 P SrP 32 2 16.885; 6.885; 6.87
90; 90; 120		282.03Zhang Guochun; Du Chenxia; Pan Shilie; Chen Chuangyan; Fu Peizhen; Wu Xicheng; Li Zhihua
Growth, structure and properties of single crystals of Sr B P O5
Chemistry of Materials (1,1989-), 2003, 15, 2218-2221
4003222 CIFC7 H D11.14 Fe O3P 32 2 121.847; 21.847; 6.8729
90; 90; 120		2840.9Gygi, David; Bloch, Eric D.; Mason, Jarad A.; Hudson, Matthew R.; Gonzalez, Miguel I.; Siegelman, Rebecca L.; Darwish, Tamim A.; Queen, Wendy L.; Brown, Craig M.; Long, Jeffrey R.
Hydrogen Storage in the Expanded Pore Metal‒Organic Frameworks M2(dobpdc) (M = Mg, Mn, Fe, Co, Ni, Zn)
Chemistry of Materials, 2016, 28, 1128
4003223 CIFC7 H D3.74 Fe O3P 32 2 121.831; 21.831; 6.8543
90; 90; 120		2829.1Gygi, David; Bloch, Eric D.; Mason, Jarad A.; Hudson, Matthew R.; Gonzalez, Miguel I.; Siegelman, Rebecca L.; Darwish, Tamim A.; Queen, Wendy L.; Brown, Craig M.; Long, Jeffrey R.
Hydrogen Storage in the Expanded Pore Metal‒Organic Frameworks M2(dobpdc) (M = Mg, Mn, Fe, Co, Ni, Zn)
Chemistry of Materials, 2016, 28, 1128
4003224 CIFC7 H D7.64 Fe O3P 32 2 121.813; 21.813; 6.8688
90; 90; 120		2830.4Gygi, David; Bloch, Eric D.; Mason, Jarad A.; Hudson, Matthew R.; Gonzalez, Miguel I.; Siegelman, Rebecca L.; Darwish, Tamim A.; Queen, Wendy L.; Brown, Craig M.; Long, Jeffrey R.
Hydrogen Storage in the Expanded Pore Metal‒Organic Frameworks M2(dobpdc) (M = Mg, Mn, Fe, Co, Ni, Zn)
Chemistry of Materials, 2016, 28, 1128
4003225 CIFC24 H28 Co2 N2 O8P 32 2 121.7036; 21.7036; 6.844
90; 90; 120		2791.93Gygi, David; Bloch, Eric D.; Mason, Jarad A.; Hudson, Matthew R.; Gonzalez, Miguel I.; Siegelman, Rebecca L.; Darwish, Tamim A.; Queen, Wendy L.; Brown, Craig M.; Long, Jeffrey R.
Hydrogen Storage in the Expanded Pore Metal‒Organic Frameworks M2(dobpdc) (M = Mg, Mn, Fe, Co, Ni, Zn)
Chemistry of Materials, 2016, 28, 1128
4003226 CIFC7 H0.98 D2.02 Fe O3P 32 2 121.848; 21.848; 6.8136
90; 90; 120		2816.6Gygi, David; Bloch, Eric D.; Mason, Jarad A.; Hudson, Matthew R.; Gonzalez, Miguel I.; Siegelman, Rebecca L.; Darwish, Tamim A.; Queen, Wendy L.; Brown, Craig M.; Long, Jeffrey R.
Hydrogen Storage in the Expanded Pore Metal‒Organic Frameworks M2(dobpdc) (M = Mg, Mn, Fe, Co, Ni, Zn)
Chemistry of Materials, 2016, 28, 1128
4003227 CIFC7 H D5.2 Fe O3P 32 2 121.823; 21.823; 6.8695
90; 90; 120		2833.2Gygi, David; Bloch, Eric D.; Mason, Jarad A.; Hudson, Matthew R.; Gonzalez, Miguel I.; Siegelman, Rebecca L.; Darwish, Tamim A.; Queen, Wendy L.; Brown, Craig M.; Long, Jeffrey R.
Hydrogen Storage in the Expanded Pore Metal‒Organic Frameworks M2(dobpdc) (M = Mg, Mn, Fe, Co, Ni, Zn)
Chemistry of Materials, 2016, 28, 1128
4020021 CIFC40.5 H27 Cl O2P 32 2 111.422; 11.422; 40.05
90; 90; 120		4525Matzger, Adam J.; Price, Christopher P.
Journal of Organic Chemistry, 2005, 70, 1-6
4020598 CIFC17 H21 N O5 SP 32 2 110.2987; 10.2987; 28.821
90; 90; 120		2647.4José L. García Ruano; Alberto Fraile; Ana M. Martín Castro; M. Rosario Martín
The Role of the Sulfinyl Group on the Course of the Reactions of 3-p-Tolylsulfinylfuran-2(5H)-ones with Nitrones. Synthetic Uses of Cycloreversion Processes
Journal of Organic Chemistry, 2005, 70, 8825-8834
4022121 CIFC156 H174 Br6 N12 O24P 32 2 134.775; 34.775; 31.201
90; 90; 120		32676.3Ho Yong Lee; Dohyun Moon; Myoung Soo Lah; Jong-In Hong
Triangular Assembly Through Charged Hydrogen Bonds in Polar Solvent
Journal of Organic Chemistry, 2006, 71, 9225-9228
4023103 CIFC13 H22 O3P 32 2 19.8192; 9.8192; 24.526
90; 90; 120		2047.9Zhenlei Song; Richard P. Hsung; Ting Lu; Andrew G. Lohse
Studies on a Urea-Directed Stork-Crabtree Hydrogenation. Synthesis of the C1-C9 Subunit of (+)-Zincophorin
Journal of Organic Chemistry, 2007, 72, 9722-9731
4026234 CIFC30 H28 N2 O4 S2P 32 2 19.1735; 9.1735; 25.9022
90; 90; 120		1887.72Wanchai Pluempanupat; Michael Abraham; Lothar Brecker; Peter Wolschann; Alfred Karpfen; Vladimir B. Arion; Michael Widhalm
Synthesis and Conformation of Chiral Biheteroaryls
Journal of Organic Chemistry, 2011, 76, 3222-3230
4026236 CIFC34 H36 N2 O4 S2P 32 2 110.7373; 10.7373; 47.341
90; 90; 120		4726.7Wanchai Pluempanupat; Michael Abraham; Lothar Brecker; Peter Wolschann; Alfred Karpfen; Vladimir B. Arion; Michael Widhalm
Synthesis and Conformation of Chiral Biheteroaryls
Journal of Organic Chemistry, 2011, 76, 3222-3230
4027650 CIFC29 H44 N6 O7.5P 32 2 113.6137; 13.6137; 30.6199
90; 90; 120		4914.58Sujeewa Ranatunga; Chih-Hang Anthony Tang; Chih-Chi Andrew Hu; Juan R. Del Valle
Total Synthesis and Structural Revision of Lucentamycin A
Journal of Organic Chemistry, 2012, 77, 9859-9864
4028386 CIFC21 H19 Br2 N O6P 32 2 118.5929; 18.5929; 14.0338
90; 90; 120		4201.5Zhen-Xin Jia; Yong-Chun Luo; Xi-Na Cheng; Peng-Fei Xu; Yu-Cheng Gu
Organocatalyzed Michael-Michael Cascade Reaction: Asymmetric Synthesis of Polysubstituted Chromans
Journal of Organic Chemistry, 2013, 78, 6488-6494
4028820 CIF
HKL		C28 H36 N2 O3P 32 2 117.3834; 17.3834; 48.1688
90; 90; 120		12605.7Joanna V. Geden; Benjamin O. Beasley; Guy J. Clarkson; Michael Shipman
Asymmetric Synthesis of 2-Substituted Oxetan-3-ones via Metalated SAMP/RAMP Hydrazones
Journal of Organic Chemistry, 2013, 78, 12243-12250
4029419 CIFC31 H28 Cl N3 O2P 32 2 114.5913; 14.5913; 24.0429
90; 90; 120		4433.1Tan, Wei; Du, Bai-Xiang; Li, Xin; Zhu, Xu; Shi, Feng; Tu, Shu-Jiang
Catalytic Asymmetric Aza-ene Reaction of 3-Indolylmethanols with Cyclic Enaminones: Enantioselective Approach to C3-Functionalized Indoles.
The Journal of organic chemistry, 2014, 79, 4635-4643
4031635 CIFCr Cs2 N5 O15P 32 2 111.062; 11.062; 9.919
90; 90; 120		1051.15Fedorova, A.A.; Chizhov, P.S.; Morozov, I.V.; Troyanov, S.I.
Synthesis and Crystal Structures of New Iron(III) and Chromium(III) Nitrate Complexes Cs[Fe(NO3)4], Cs2[Cr(NO3)5], and Cs3[Cr(NO3)6]
Russian Journal of Inorganic Chemistry (= Zhurnal Neorganicheskoi Khimii), 2002, 47, 1845-1852
4034127 CIFC24 H33 Cl2 O P PdP 32 2 115.7436; 15.7436; 19.151
90; 90; 120		4110.8Zhang, Yu; Nie, Shao-Zhen; Ye, Jing-Jing; Wang, Ji-Ping; Zhou, Meng-Meng; Zhao, Chang-Qiu; Li, Qiang
Functional Phosphine Derivatives Having Stationary and Flexible Chiralities: Their Preparation and Chirality Controlling.
The Journal of organic chemistry, 2019, 84, 8423-8439
4034506 CIFC54 H76 O4 S2P 32 2 113.0211; 13.0211; 25.5008
90; 90; 120		3744.38Kortus, Daniel; Mikšátko, Jiří; Kundrát, Ondřej; Babor, Martin; Eigner, Václav; Dvořáková, Hana; Lhoták, Pavel
Chemistry of 2,14-Dithiacalix[4]arene: Alkylation and Conformational Behavior of Peralkylated Products.
The Journal of organic chemistry, 2019, 84, 11572-11580
4035112 CIFC16 H18 O3P 32 2 111.3565; 11.3565; 9.147
90; 90; 120		1021.64Pilevar, Afsaneh; Hosseini, Abolfazl; Šekutor, Marina; Hausmann, Heike; Becker, Jonathan; Turke, Kevin; Schreiner, Peter R.
Tuning the Reactivity of Peroxo Anhydrides for Aromatic C-H Bond Oxidation.
The Journal of organic chemistry, 2018, 83, 10070-10079
4035124 CIFC68 H24 O8P 32 2 111.8424; 11.8424; 23.682
90; 90; 120		2876.26Ueno, Hiroshi; Uchiyama, Kouya; Ma, Yue; Watanabe, Keita; Yoza, Kenji; Matsuo, Yutaka; Moriyama, Hiroshi
Octaalkoxyfullerenes: Widely LUMO-Tunable C<sub>2 v</sub>-Symmetric Fullerene Derivatives.
The Journal of organic chemistry, 2018, 83, 10655-10659
4035282 CIFC28 H33 N O7P 32 2 120.0368; 20.0368; 12.7561
90; 90; 120		4435.12Zhou, Ming; Zhou, Jia; Liu, Junjun; Liang, Jing-Jing; Peng, Xiao-Gang; Duan, Fang-Fang; Ruan, Han-Li
Parasubindoles A-G, Seven Eremophilanyl Indoles from the Whole Plant of Parasenecio albus.
The Journal of organic chemistry, 2018, 83, 12122-12128
4036164 CIFC12 H21 N O3 SP 32 2 19.1098; 9.1098; 29.0236
90; 90; 120		2085.93Chernykh, Anton V.; Radchenko, Dmytro S.; Grygorenko, Oleksandr O.; Daniliuc, Constantin G.; Volochnyuk, Dmitriy M.; Komarov, Igor V.
Synthesis and structural analysis of angular monoprotected diamines based on spiro[3.3]heptane scaffold.
The Journal of organic chemistry, 2015, 80, 3974-3981
4062405 CIFC41 H76 N10 O Zr2P 32 2 113.3607; 13.3607; 23.5264
90; 90; 120		3637.01Hagadorn, John R.; McNevin, Michael J.; Wiedenfeld, Grant; Shoemaker, Richard
Dizirconium Complexes Supported by Preorganized Binucleating Bis(amidinates)
Organometallics, 2003, 22, 4818-4824
4065681 CIFC50 H72 I4 N8 Zn4P 32 2 112.208; 12.208; 34.722
90; 90; 120		4481.5Gutschank, Benjamin; Schulz, Stephan; Westphal, Ulrich; Bläser, Dieter; Boese, Roland
Synthesis and X-ray Crystal Structures of Tetranuclear Zincamidinate Complexes
Organometallics, 2010, 29, 2093
4069862 CIFC26 H52 Br N2 O P2 ReP 32 2 111.225; 11.225; 21.6967
90; 90; 120		2367.54Jiang, Yanfeng; Blacque, Olivier; Fox, Thomas; Frech, Christian M.; Berke, Heinz
Development of Rhenium Catalysts for Amine Borane Dehydrocoupling and Transfer Hydrogenation of Olefins
Organometallics, 2009, 28, 5493
4073277 CIFC44 H50 Cl2 P2 Ru2P 32 2 118.011; 18.011; 12.1888
90; 90; 120		3424.3Miyake, Yoshihiro; Nomaguchi, Yohei; Yuki, Masahiro; Nishibayashi, Yoshiaki
Synthesis and Reactivity of Diphosphine-Bridged Diruthenium Complexes
Organometallics, 2007, 26, 3611
4073797 CIFC54 H64 Cl2 N4 O Rh2P 32 2 111.9962; 11.9962; 28.3024
90; 90; 120		3527.3Jeletic, Matthew S.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S.
Mono- and Bimetallic Rhodium(I) Complexes Supported by NewC2-Symmetric Bis-N-heterocyclic Carbene Ligands: Metalation via CC Bond Cleavage under Mild Conditions
Organometallics, 2007, 26, 5267
4078639 CIFC84 H80 F12 O5 P6 Pd2 S2P 32 2 114.9538; 14.9538; 30.2975
90; 90; 120		5867.3Suess, Daniel L. M.; Peters, Jonas C.
Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes
Organometallics, 2012, 31, 5213
4079829 CIFC20 H12 F2 O2P 32 2 110.68954; 10.68954; 23.2454
90; 90; 120		2300.31Hrdina, Radim; Guénée, Laure; Moraleda, Delphine; Lacour, Jérôme
Synthesis, Structural Analysis, and Catalytic Properties of Tetrakis(binaphthyl or octahydrobinaphthyl phosphate) Dirhodium(II,II) Complexes
Organometallics, 2013, 32, 473
4081364 CIFC14 H22 F3 N3 O4 Pd SP 32 2 111.60504; 11.60504; 24.7296
90; 90; 120		2884.3Frutos-Pedre Roberto; González-Herrero, Pablo; Vicente, José; Jones, Peter G.
Reactivity of Ortho-Palladated Benzamides toward CO, Isocyanides, and Alkynes. Synthesis of Functionalized Isoindolin-1-ones and 4,5-Disubstituted Benzo[c]azepine-1,3-diones
Organometallics, 2013, 32, 4664
4081506 CIFC68 H62 F6 Fe N6 O18 Pd2 S4P 32 2 114.211; 14.211; 31.1139
90; 90; 120		5441.7Weber, Manuel; Klein, Johannes E. M. N.; Miehlich, Burkhard; Frey, Wolfgang; Peters, René
Monomeric Ferrocene Bis-Imidazoline Bis-Palladacycles: Variation of Pd‒Pd Distances by an Interplay of Metallophilic, Dispersive, and Coulombic Interactions
Organometallics, 2013, 32, 5810
4085003 CIFC52 H72 Cl4 N2 O2 P2 Pd2P 32 2 120.139; 20.139; 13.7756
90; 90; 120		4838.6Serin, Spencer C.; Patrick, Brian O.; Dake, Gregory R.; Gates, Derek P.
Reaction of an Enantiomerically Pure Phosphaalkene-Oxazoline with MeM Nucleophiles (M = Li and MgBr): Stereoselectivity and Noninnocence of the P-Mesityl Substituent
Organometallics, 2014, 141201152116001
4101246 CIFC846 H1919 N262 O491 S8.83P 32 2 165.68; 65.68; 79.46
90; 90; 120		296844Fuhrmann, Cynthia N; Daugherty, Matthew D; Agard, David A
Subangstrom crystallography reveals that short ionic hydrogen bonds, and not a His-Asp low-barrier hydrogen bond, stabilize the transition state in serine protease catalysis.
Journal of the American Chemical Society, 2006, 128, 9086-9102
4101247 CIFC846 H2027 B N262 O581 S9.5P 32 2 165.77; 65.77; 79.55
90; 90; 120		298004Fuhrmann, Cynthia N; Daugherty, Matthew D; Agard, David A
Subangstrom crystallography reveals that short ionic hydrogen bonds, and not a His-Asp low-barrier hydrogen bond, stabilize the transition state in serine protease catalysis.
Journal of the American Chemical Society, 2006, 128, 9086-9102
4101427 CIFC319.5 H235 Au10 Cl15 F30 N12 O20 P10P 32 2 136.405; 36.405; 49.917
90; 90; 120		57294Wheaton, Craig A; Eisler, Dana J; Jennings, Michael C; Puddephatt, Richard J
Self-assembly of coordination polymers: evidence for dynamic exchange between oligomers in solution and the isolation of a homochiral decagold(I) oligomer.
Journal of the American Chemical Society, 2006, 128, 15370-15371
4101631 CIFC62 H135 Fe0.5 Mo9 N5.5 O30P 32 2 118.286; 18.286; 49.079
90; 90; 120		14212Zhang, Jin; Hao, Jian; Wei, Yongge; Xiao, Fengping; Yin, Panchao; Wang, Longsheng
Nanoscale chiral rod-like molecular triads assembled from achiral polyoxometalates.
Journal of the American Chemical Society, 2010, 132, 14-15
4104427 CIFC30 H51 Au2 Cl12 P2P 32 2 115.787; 15.787; 30.811
90; 90; 120		6650.2Thomas S. Teets; Daniel G. Nocera
Halogen Photoreductive Elimination from Gold(III) Centers
Journal of the American Chemical Society, 2009, 131, 7411-7420
4105991 CIFC14 H25 B N O PP 32 2 112.7622; 12.7622; 33.2409
90; 90; 120		4688.7Thierry León; Antoni Riera; Xavier Verdaguer
Stereoselective Synthesis of P-Stereogenic Aminophosphines: Ring Opening of Bulky Oxazaphospholidines
Journal of the American Chemical Society, 2011, 133, 5740-5743
4106631 CIFC47 H68 O2 ThP 32 2 117.0548; 17.0548; 12.2849
90; 90; 120		3094.5Wenshan Ren; Guofu Zi; De-Cai Fang; Marc D. Walter
Thorium Oxo and Sulfido Metallocenes: Synthesis, Structure, Reactivity, and Computational Studies
Journal of the American Chemical Society, 2011, 133, 13183-13196
4106838 CIFC32 H34 N2 O7 SP 32 2 111.9335; 11.9335; 36.635
90; 90; 120		4518.2Yankai Liu; Manuel Nappi; Elena Arceo; Silvia Vera; Paolo Melchiorre
Asymmetric Catalysis of Diels-Alder Reactions with in Situ Generated Heterocyclic ortho-Quinodimethanes
Journal of the American Chemical Society, 2011, 133, 15212-15218
4108891 CIFC24 H44 In N O10P 32 2 112.9913; 12.9913; 17.3911
90; 90; 120		2541.93Jian Zhang; Shumei Chen; Areg Zingiryan; Xianhui Bu
Integrated Molecular Chirality, Absolute Helicity, and Intrinsic Chiral Topology in Three-Dimensional Open-Framework Materials
Journal of the American Chemical Society, 2008, 130, 17246-17247
4108918 CIFC42.75 H70.13 Lu N13.88 O12.75P 32 2 114.982; 14.982; 38.92
90; 90; 120		7566Janusz Gregoliński; Przemysław Starynowicz; KimNgan T. Hua; Jamie L. Lunkley; Gilles Muller; Jerzy Lisowski
Helical Lanthanide(III) Complexes with Chiral Nonaaza Macrocycle
Journal of the American Chemical Society, 2008, 130, 17761-17773
4109408 CIFC108 H96 Cr2 Fe3 N24P 32 2 124.8535; 24.8535; 20.228
90; 90; 120		10820.8Mikhail Shatruk; Alina Dragulescu-Andrasi; Kristen Chambers; Sebastian A. Stoian; Emile L. Bominaar; Catalina Achim; Kim R. Dunbar
Properties of Prussian Blue Materials Manifested in Molecular Complexes: Observation of Cyanide Linkage Isomerism and Spin-Crossover Behavior in Pentanuclear Cyanide Clusters
Journal of the American Chemical Society, 2007, 129, 6104-6116
4109771 CIFC30 H36 O6P 32 2 114.1676; 14.1676; 10.8602
90; 90; 120		1887.8Arunkumar Natarajan; C. K. Tsai; Saeed I. Khan; Patrick McCarren; K. N. Houk; Miguel A. Garcia-Garibay
The Photoarrangement of α-Santonin is a Single-Crystal-to-Single-Crystal Reaction: A Long Kept Secret in Solid-State Organic Chemistry Revealed
Journal of the American Chemical Society, 2007, 129, 9846-9847
4111325 CIFC20 H20 Cl2 O Zr2P 32 2 17.8384; 7.8384; 27.668
90; 90; 120		1472.19Jared T. Spletstoser; Jonathan M. White; Ashok Rao Tunoori; Gunda I. Georg
Mild and Selective Hydrozirconation of Amides to Aldehydes Using Cp2Zr(H)Cl: Scope and Mechanistic Insight
Journal of the American Chemical Society, 2007, 129, 3408-3419
4111616 CIFC99 H114 N8 O15 P2P 32 2 118.4724; 18.4724; 21.479
90; 90; 120		6347.3Thomas P. Clark; Clark R. Landis; Susan L. Freed; Jerzy Klosin; Khalil A. Abboud
Highly Active, Regioselective, and Enantioselective Hydroformylation with Rh Catalysts Ligated by Bis-3,4-diazaphospholanes
Journal of the American Chemical Society, 2005, 127, 5040-5042
4111892 CIFC158 H138 Cd17 N4 S32P 32 2 119.172; 19.172; 45.758
90; 90; 120		14566Nanfeng Zheng; Xianhui Bu; Haiwei Lu; Qichun Zhang; Pingyun Feng
Crystalline Superlattices from Single-Sized Quantum Dots
Journal of the American Chemical Society, 2005, 127, 11963-11965
4112136 CIFC53.33 H55.33 Cl4 Cu2 Fe2 P2 S2P 32 2 117.7079; 17.7079; 15.0264
90; 90; 120		4080.56Olga García Mancheño; Ramón Gómez Arrayás; Juan C. Carretero
Chiral Copper Complexes of Phosphino Sulfenyl Ferrocenes as Efficient Catalysts for Enantioselective Formal Aza Diels-Alder Reactions of N-Sulfonyl Imines
Journal of the American Chemical Society, 2004, 126, 456-457
4112613 CIFC16 H42 Cl2 Co N4 O14P 32 2 18.724; 8.724; 33.476
90; 90; 120		2206.46Hiroyuki Miyake; Kana Yoshida; Hideki Sugimoto; Hiroshi Tsukube
Dynamic Helicity Inversion by Achiral Anion Stimulus in Synthetic Labile Cobalt(II) Complex
Journal of the American Chemical Society, 2004, 126, 6524-6525
4113253 CIFC53 H56 B2 N2 O9P 32 2 119.4347; 19.4347; 30.1815
90; 90; 120		9872.5Jianzhang Zhao; Matthew G. Davidson; Mary F. Mahon; Gabriele Kociok-Köhn; Tony D. James
An Enantioselective Fluorescent Sensor for Sugar Acids
Journal of the American Chemical Society, 2004, 126, 16179-16186
4114550 CIFC25 H37 N3 O6P 32 2 115.0005; 15.0005; 21.8165
90; 90; 120		4251.35Claudio Palomo; Jesus M. Aizpurua; Ana Benito; José Ignacio Miranda; Raluca M. Fratila; Carlos Matute; Maria Domercq; Federico Gago; Sonsoles Martin-Santamaria; Anthony Linden
Development of a New Family of Conformationally Restricted Peptides as Potent Nucleators of β-Turns. Design, Synthesis, Structure, and Biological Evaluation of a β-Lactam Peptide Analogue of Melanostatin
Journal of the American Chemical Society, 2003, 125, 16243-16260
4115591 CIFC45 H66.5 Cu5 La N12.5 O26P 32 2 115.2671; 15.2671; 48.4117
90; 90; 120		9772.24Annabel D. Cutland; Jason A. Halfen; Jeff W. Kampf; Vincent L. Pecoraro
Chiral 15-Metallacrown-5 Complexes Differentially Bind Carboxylate Anions
Journal of the American Chemical Society, 2001, 123, 6211-6212
4117002 CIFC116 H92 Br2 Cl4 O4P 32 2 117.493; 17.493; 26.676
90; 90; 120		7069.4Ling Tong; Douglas M. Ho; Nancy J. Vogelaar; Clarence E. Schutt; Robert A. Pascal
The Albatrossenes: Large, Cleft-Containing, Polyphenyl Polycyclic Aromatic Hydrocarbons
Journal of the American Chemical Society, 1997, 119, 7291-7302
4117850 CIFC12 H14 N O4 ZnP 32 2 121.698; 21.698; 6.869
90; 90; 120		2800.7Thomas M. McDonald; Woo Ram Lee; Jarad A. Mason; Brian M. Wiers; Chang Seop Hong; Jeffrey R. Long
Capture of Carbon Dioxide from Air and Flue Gas in the Alkylamine-Appended Metal-Organic Framework mmen-Mg2(dobpdc)
Journal of the American Chemical Society, 2012, 134, 7056-7065
4118361 CIFC24 H29 O9 PP 32 2 110.583; 10.583; 39.571
90; 90; 120		3838Angélique Ferry; Xavier Guinchard; Pascal Retailleau; David Crich
Synthesis, Characterization, and Coupling Reactions of Six-Membered Cyclic P-Chiral Ammonium Phosphonite-Boranes; Reactive H-Phosphinate Equivalents for the Stereoselective Synthesis of Glycomimetics
Journal of the American Chemical Society, 2012, 134, 12289-12301
4119731 CIFC9 H18 O6P 32 2 19.4244; 9.4244; 22.8217
90; 90; 120		1755.44Koichiro Mikami; Alexander T. Lonnecker; Tiffany P. Gustafson; Nathanael F. Zinnel; Pei-Jing Pai; David H. Russell; Karen L. Wooley
Polycarbonates Derived from Glucose via an Organocatalytic Approach
Journal of the American Chemical Society, 2013, 135, 6826-6829
4121097 CIFC38 H34 F6 N3 O3 P SP 32 2 122.8761; 22.8761; 14.2626
90; 90; 120		6463.88Marta G. Núñez; Alistair J. M. Farley; Darren J. Dixon
Bifunctional Iminophosphorane Organocatalysts for Enantioselective Synthesis: Application to the Ketimine Nitro-Mannich Reaction
Journal of the American Chemical Society, 2013, 135, 16348-16351
4122255 CIFC20 H23 Fe N9 O4P 32 2 114.1554; 14.1554; 9.807
90; 90; 120		1701.8Sanders, Brian C.; Hassan, Sayed M.; Harrop, Todd C.
NO2(-) Activation and Reduction to NO by a Nonheme Fe(NO2)2 Complex.
Journal of the American Chemical Society, 2014, 136, 10230-10233
4125484 CIFC55 H60 O5P 32 2 125.4957; 25.4957; 6.2727
90; 90; 120		3531.2Darzi, Evan R.; White, Brittany M.; Loventhal, Lance K.; Zakharov, Lev N.; Jasti, Ramesh
An Operationally Simple and Mild Oxidative Homocoupling of Aryl Boronic Esters To Access Conformationally Constrained Macrocycles.
Journal of the American Chemical Society, 2017, 139, 3106-3114
4126285 CIFC20.48 H22.2 N3.24 O9.24 Zn2P 32 2 121.2594; 21.2594; 6.7655
90; 90; 120		2648.1Siegelman, Rebecca L.; McDonald, Thomas M.; Gonzalez, Miguel I.; Martell, Jeffrey; Milner, Phillip J.; Mason, Jarad A.; Berger, Adam H.; Bhown, Abhoyjit S.; Long, Jeffrey R.
Controlling Cooperative CO2 Adsorption in Diamine-Appended Mg2(dobpdc) Metal-Organic Frameworks.
Journal of the American Chemical Society, 2017
4126286 CIFC27 H38 N4 O8 Zn2P 32 2 121.6857; 21.6857; 6.8891
90; 90; 120		2805.69Siegelman, Rebecca L.; McDonald, Thomas M.; Gonzalez, Miguel I.; Martell, Jeffrey; Milner, Phillip J.; Mason, Jarad A.; Berger, Adam H.; Bhown, Abhoyjit S.; Long, Jeffrey R.
Controlling Cooperative CO2 Adsorption in Diamine-Appended Mg2(dobpdc) Metal-Organic Frameworks.
Journal of the American Chemical Society, 2017
4126288 CIFC23.89 H33.97 N3.3 O6.8 Zn2P 32 2 121.662; 21.662; 6.8262
90; 90; 120		2774Siegelman, Rebecca L.; McDonald, Thomas M.; Gonzalez, Miguel I.; Martell, Jeffrey; Milner, Phillip J.; Mason, Jarad A.; Berger, Adam H.; Bhown, Abhoyjit S.; Long, Jeffrey R.
Controlling Cooperative CO2 Adsorption in Diamine-Appended Mg2(dobpdc) Metal-Organic Frameworks.
Journal of the American Chemical Society, 2017
4126401 CIFC21.89 H25.94 N2.85 O7.55 Zn2P 32 2 121.653; 21.653; 6.7873
90; 90; 120		2755.9Milner, Phillip J.; Siegelman, Rebecca L.; Forse, Alexander C.; Gonzalez, Miguel I.; Runčevski, Tomče; Martell, Jeffrey D.; Reimer, Jeffrey A.; Long, Jeffrey R.
A Diaminopropane-Appended Metal‒Organic Framework Enabling Efficient CO2 Capture from Coal Flue Gas via a Mixed Adsorption Mechanism
Journal of the American Chemical Society, 2017
4126641 CIFC28 H34 N4 O10 Zn2P 32 2 120.6012; 20.6012; 6.8939
90; 90; 120		2533.85Martell, Jeffrey D.; Porter-Zasada, Leo B; Forse, Alexander C.; Siegelman, Rebecca L.; Gonzalez, Miguel I.; Oktawiec, Julia; Runcevski, Tomce; Xu, Jiawei; Srebro-Hooper, Monika; Milner, Phillip J.; Colwell, Kristen A.; Autschbach, Jochen; Reimer, Jeffrey A.; Long, Jeffrey R.
Enantioselective Recognition of Ammonium Carbamates in a Chiral Metal-Organic Framework.
Journal of the American Chemical Society, 2017
4128179 CIFC32 H32 Cl F5 N2 O2 Ru SP 32 2 114.9367; 14.9367; 27.3869
90; 90; 120		5291.5Dub, Pavel A.; Matsunami, Asuka; Kuwata, Shigeki; Kayaki, Yoshihito
Cleavage of N-H Bond of Ammonia via Metal-Ligand Cooperation Enables Rational Design of a Conceptually New Noyori-Ikariya Catalyst.
Journal of the American Chemical Society, 2019, 141, 2661-2677
4128303 CIFC22 H27 N2 O8.5P 32 2 19.883; 9.883; 36.809
90; 90; 120		3113.6Thesmar, Pierre; Baudoin, Olivier
Efficient and Divergent Total Synthesis of (-)-Epicoccin G and (-)-Rostratin A Enabled by Double C(sp<sup>3</sup>)-H Activation.
Journal of the American Chemical Society, 2019, 141, 15779-15783
4128517 CIFC20 H30 O4P 32 2 111.2006; 11.2006; 25.1011
90; 90; 120		2727.13Dong, Liao-Bin; Zhang, Xiao; Rudolf, Jeffrey D.; Deng, Ming-Rong; Kalkreuter, Edward; Cepeda, Alexis J.; Renata, Hans; Shen, Ben
Cryptic and Stereospecific Hydroxylation, Oxidation, and Reduction in Platensimycin and Platencin Biosynthesis.
Journal of the American Chemical Society, 2019, 141, 4043-4050
4128684 CIFC182.67 H102 O60 P3 Zr9P 32 2 145.122; 45.122; 49.238
90; 90; 120		86818Gong, Wei; Chen, Xu; Jiang, Hong; Chu, Dandan; Cui, Yong; Liu, Yan
Highly Stable Zr(IV)-Based Metal-Organic Frameworks with Chiral Phosphoric Acids for Catalytic Asymmetric Tandem Reactions.
Journal of the American Chemical Society, 2019, 141, 7498-7508
4129075 CIFC18 H15 N O5P 32 2 111.8237; 11.8237; 19.047
90; 90; 120		2306.03Tanwar, Lalita; Börgel, Jonas; Ritter, Tobias
Synthesis of Benzylic Alcohols by C-H Oxidation.
Journal of the American Chemical Society, 2019, 141, 17983-17988
4129431 CIFC21 H28 O2P 32 2 110.7904; 10.7904; 26.1124
90; 90; 120		2633.01Rajendar, Goreti; Corey, E. J.
A systematic study of functionalized oxiranes as initiating groups for cationic polycyclization reactions.
Journal of the American Chemical Society, 2015, 137, 5837-5844
4131080 CIFC26 H26 F9 N3 O SP 32 2 112.3403; 12.3403; 31.681
90; 90; 120		4178.1Kennedy, C. Rose; Lehnherr, Dan; Rajapaksa, Naomi S.; Ford, David D.; Park, Yongho; Jacobsen, Eric N.
Mechanism-Guided Development of a Highly Active Bis-thiourea Catalyst for Anion-Abstraction Catalysis.
Journal of the American Chemical Society, 2016, 138, 13525-13528
4131081 CIFC25 H25 F8 N3 O SP 32 2 112.8221; 12.8221; 26.6228
90; 90; 120		3790.55Kennedy, C. Rose; Lehnherr, Dan; Rajapaksa, Naomi S.; Ford, David D.; Park, Yongho; Jacobsen, Eric N.
Mechanism-Guided Development of a Highly Active Bis-thiourea Catalyst for Anion-Abstraction Catalysis.
Journal of the American Chemical Society, 2016, 138, 13525-13528
4131083 CIFC23 H27 Cl2 N3 O SP 32 2 112.1213; 12.1213; 27.5249
90; 90; 120		3502.31Kennedy, C. Rose; Lehnherr, Dan; Rajapaksa, Naomi S.; Ford, David D.; Park, Yongho; Jacobsen, Eric N.
Mechanism-Guided Development of a Highly Active Bis-thiourea Catalyst for Anion-Abstraction Catalysis.
Journal of the American Chemical Society, 2016, 138, 13525-13528
4131093 CIFC64 H70 Cl F14 N7 O6 S2P 32 2 114.3464; 14.3464; 28.5097
90; 90; 120		5081.7Kennedy, C. Rose; Lehnherr, Dan; Rajapaksa, Naomi S.; Ford, David D.; Park, Yongho; Jacobsen, Eric N.
Mechanism-Guided Development of a Highly Active Bis-thiourea Catalyst for Anion-Abstraction Catalysis.
Journal of the American Chemical Society, 2016, 138, 13525-13528
4131507 CIFC6 H14 Br3 N2 RbP 32 2 19.6444; 9.6444; 23.254
90; 90; 120		1873.2Zhang, Wan-Ying; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Liao, Wei-Qiang; Fu, Da-Wei; Ye, Heng-Yun; Zhang, Yi; Xiong, Ren-Gen
Precise Molecular Design of High-T<sub>c</sub> 3D Organic-Inorganic Perovskite Ferroelectric: [MeHdabco]RbI<sub>3</sub> (MeHdabco = N-Methyl-1,4-diazoniabicyclo[2.2.2]octane).
Journal of the American Chemical Society, 2017, 139, 10897-10902
4135314 CIFC18 H14 Br N O3P 32 2 111.4685; 11.4685; 42.486
90; 90; 120		4839.38Chen, Wenchao; Ang, Esther Cai Xia; Tan, Siu Min; Chua, Zhijie; Ren, Jingyun; Yang, Ziqi; Teng, Bo; Lee, Richmond; Lu, Haihua; Tan, Choon-Hong
Enantioselective Addition-Alkylation of α,β-Unsaturated Carbonyls via Bisguanidinium Silicate Ion Pair Catalysis
Journal of the American Chemical Society, 2020
4306693 CIFC21 H15 N3 O6 Tc2P 32 2 110.088; 10.088; 19.817
90; 90; 120		1746.5Maaz Zuhayra; Ulf Lützen; Arne Lützen; Laszlo Papp; Eberhard Henze; Gernot Friedrichs; Franz Oberdorfer
C-H Bond Activation of Coordinated Pyridine: Ortho-Pyridyl-Ditechnetiumhydridocarbonyl Metal Cyclus. Crystal Structure and Dynamic Behavior in Solution
Inorganic Chemistry, 2008, 47, 10177-10182
4311178 CIFC26.5 H25 Ag Cl F6 N8 PP 32 2 112.442; 12.442; 17.6269
90; 90; 120		2363.1Daniel L. Reger; James R. Gardinier; Mark D. Smith
Tuning the Coordination Geometry of Silver in Bis(pyrazolyl)alkane Complexes
Inorganic Chemistry, 2004, 43, 3825-3832
4311717 CIFC53.5 H43 Cl2 N7 Ni O10.5P 32 2 111.6939; 11.6939; 33.013
90; 90; 120		3909.6Shane G. Telfer; Tomohiro Sato; Takunori Harada; Reiko Kuroda; Julie Lefebvre; Daniel B. Leznoff
Mono- and Dinuclear Complexes of Chiral Tri- and Tetradentate Schiff-Base Ligands Derived from 1,1'-Binaphthyl-2,2'-diamine
Inorganic Chemistry, 2004, 43, 6168-6176
4314741 CIFC18 H29 Cl0.5 Co Cr0.5 N6 O8P 32 2 116.0231; 16.0231; 18.52
90; 90; 120		4117.79Yuan-Zhu Zhang; Osamu Sato
A Cyano-Bridged CrIIICoII Ferromagnet with a Chiral Nanotubular Structure Constituted of Interlocked Single and Double Helices
Inorganic Chemistry, 2010, 49, 1271-1273
4318532 CIFC4 H8 Cd F4 Mo N2 O4P 32 2 17.4328; 7.4328; 16.376
90; 90; 120		783.51Paul A. Maggard; Amy L. Kopf; Charlotte L. Stern; Kenneth R. Poeppelmeier; Kang Min Ok; P. Shiv Halasyamani
From Linear Inorganic Chains to Helices: Chirality in the M(pyz)(H2O)2MoO2F4 (M = Zn, Cd) Compounds
Inorganic Chemistry, 2002, 41, 4852-4858
4324925 CIFC42 H90 Cl2 N10 Ni2 O12 S2P 32 2 119.0992; 19.0992; 17.8228
90; 90; 120		5630.4Huan-Yong Li; Long Jiang; Hua Xiang; Trevor A. Makal; Hong-Cai Zhou; Tong-Bu Lu
Construction of Two 3D Homochiral Frameworks with 1D Chiral Pores via Chiral Recognition
Inorganic Chemistry, 2011, 50, 3177-3179

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