Crystallography Open Database

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1008257 CIFC H4 F3 N2 O SbP c a 218.846; 8.378; 7.241
90; 90; 90		536.6Bourgault, M; Fourcade, R; Ducourant, B; Mascherpa, G
Structure cristalline de (N H~2~)~2~ C O, Sb F~3~
Revue de Chimie Minerale, 1979, 16, 151-156
1009039 CIFCo H3 O4 PP c a 218.984; 7.918; 10.139
90; 90; 90		721.2Sapina, F; Gomez-Romero, P; Marcos, M D; Amoros, P; Ibanez, R; Beltran, D; Navarro, R; Rillo, C; Lera, F
Two new cobalt(II) compounds exhibiting weak ferromagnetism: magnetic susceptibility study of Co H P O3 . H2 O and Co Cl (H2 P O2) . (H2 O) and crystal structure of Co H P O3 . H2 O
European Journal of Solid State Inorganic Chemistry, 1989, 26, 603-617
1010203 CIFF2 I K O2P c a 218.38; 5.97; 8.41
90; 90; 90		420.7Helmholz, L; Rogers, M T
The Crystal Structure of Potassium Fluoroiodate, K I O~2~ F~2~
Journal of the American Chemical Society, 1940, 62, 1537-1542
1011295 CIFC H2 Na2 O4P c a 2110.721; 5.243; 6.44
90; 90; 90		362Harper, J P
Crystal structure of sodium carbonate monohydrate, Na2 C O3 H2 O
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1936, 95, 266-273
1100195 CIFC24 H60 Cl4 Li2 Mo2 O17P c a 2120.449; 12.7631; 16.5388
90; 90; 90		4316.5K.Harms; M.Marsch
Private Communication, 2000
1100393 CIFC25 H35 Cl7 N3 P3 Ti2P c a 2112.21; 14.075; 21.393
90; 90; 90		3676.51Rübenstahl, T.; Weller, F.; Harms, K.; Dehnicke, K.; Fenske, D.; Baum, G.
Phosphaniminato-Komplexe des Titans. Synthese und Kristallstrukturen von CpTiCl2(NPMe~3~), [TiCl~3~(NPMe~3~)]~2~, [Ti~2~Cl~5~(NPMe~2~Ph)~3~] und [Ti~3~Cl~6~(NPMe~3~)~5~][BPh~4~]
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1994, 620, 1741-1749
1100446 CIFC12 H30 Cl2 N2 P2 SP c a 2112.99; 11.579; 12.653
90; 90; 90		1903.15Kunkel, F.; Harms, K.; Kang, H.-C.; Massa, W.; Dehnicke, K.
Phosphaniminato-Komplexe des Schwefels. Kristallstrukturen von [S(NPEt~3~)~3~]Cl, [S(NPEt~3~)~2~]Cl~2~ und [Me~3~SiOSO~2~NPPh~3~]
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1997, 623, 962-966
1100454 CIFC9 H29 Cl2 N Sn3P c a 2113.732; 7.622; 19.515
90; 90; 90		2042.54Hillwig, R.; Harms, K.; Dehnicke, K.; Müller, U.
Elementorganisch substituierte Ammonium-Salze. Die Kristallstrukturen von [HN(SnMe~3~)~3~]I, [H~2~N(SnMe~3~)~2~][SnMe~3~Cl~2~] und [N(AsMe~3~)~2~]Br
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1997, 623, 676-682
1100803 CIFC13 H23 Cl N2 O PdP c a 2118.2636; 9.3501; 9.2895
90; 90; 90		1586.34Vicente, José; Arcas, Aurelia; Fernández-Hernández, Jesús M.; Bautista, Delia; Jones, Peter G.
Reactivity of [Pd{CH~2~C(O)Me}Cl]~n~ toward Isocyanides
Organometallics, 2005, 24, 2516-2527
1501673 CIFC16 H30 N4 O8 S8P c a 2111.432; 24.09; 10.121
90; 90; 90		2787Shi, Zheng; Lu, Zhe-Jun; Zhu, Qin-Yu; Huo, Li-Bin; Han, Qiong-Hua; Bian, Guo-Qing; Dai, Jie
Diamino-diamido tetrathiafulvalene for the sensing of anions and cations: a view in electrochemistry and structure.
The journal of physical chemistry. B, 2011, 115, 3020-3026
1501901 CIFC42 H42 B NP c a 2123.245; 11.539; 12.288
90; 90; 90		3295.9Hudson, Zachary M.; Liu, Xiang-Yang; Wang, Suning
Switchable Three-State Fluorescence of a Nonconjugated Donor‒Acceptor Triarylborane
Organic Letters, 2011, 13, 300-303
1502604 CIFC22 H23 N O4 SP c a 2115.819; 11.095; 11.877
90; 90; 90		2085Zheng, Huaiji; Huo, Xing; Zhao, Changgui; Jing, Peng; Yang, Juan; Fang, Bowen; She, Xuegong
Au-catalyzed piperidine synthesis via tandem acyloxy migration/intramolecular [3 + 2] cycloaddition of enynyl esters.
Organic letters, 2011, 13, 6448-6451
1502701 CIFC3 H5 O2 TlP c a 217.302; 10.636; 21.028
90; 90; 90		1633.1Martínez Casado, F J; Ramos Riesco, M.; da Silva, I.; Labrador, A.; Redondo, M. I.; García Pérez, M V; López-Andrés, S; Rodríguez Cheda, J A
Thermal and structural study of the crystal phases and mesophases in the lithium and thallium(i) propanoates and pentanoates binary systems: formation of mixed salts and stabilization of the ionic liquid crystal phase.
The journal of physical chemistry. B, 2010, 114, 10075-10085
1502961 CIFC14 H20 Br2 Se2 Si2P c a 2128.649; 7.6936; 18.557
90; 90; 90		4090.2Getmanenko, Yulia A.; Tongwa, Paul; Timofeeva, Tatiana V.; Marder, Seth R.
Base-catalyzed halogen dance reaction and oxidative coupling sequence as a convenient method for the preparation of dihalo-bisheteroarenes.
Organic letters, 2010, 12, 2136-2139
1503035 CIFC24 H40 O3 SiP c a 2120.0329; 6.5664; 17.1418
90; 90; 90		2254.9Lazarski, Kiel E.; Hu, Dennis X.; Stern, Charlotte L.; Thomson, Regan J.
A synthesis of the carbocyclic core of maoecrystal V.
Organic letters, 2010, 12, 3010-3013
1503059 CIFC26 H37 N O5P c a 2116.5169; 5.7641; 50.954
90; 90; 90		4851.1Burke, Jason P.; Sabat, Michal; Iovan, Diana A.; Myers, William H.; Chruma, Jason J.
Exploring the original proposed biosynthesis of (+)-symbioimine: remote exocyclic stereocontrol in a type I IMDA reaction.
Organic letters, 2010, 12, 3192-3195
1503137 CIFC13 H14 O4P c a 2111.0204; 8.2388; 12.1197
90; 90; 90		1100.41Cordes, Jens; Harms, Klaus; Koert, Ulrich
Synthesis of the isoquinocycline-pyrrolopyrrole substructure.
Organic letters, 2010, 12, 3808-3811
1503343 CIFC10 H8 F3 N O4P c a 2118.015; 8.9617; 6.7552
90; 90; 90		1090.6Kole, Goutam Kumar; Tan, Geok Kheng; Vittal, Jagadese J.
Anion-controlled stereoselective synthesis of cyclobutane derivatives by solid-state [2 + 2] cycloaddition reaction of the salts of trans-3-(4-pyridyl) acrylic acid.
Organic letters, 2010, 12, 128-131
1503493 CIFC21 H21 N O4P c a 2111.8807; 19.0098; 8.062
90; 90; 90		1820.8Hong, Bor-Cherng; Dange, Nitin S.; Ding, Chun-Feng; Liao, Ju-Hsiou
Organocatalytic Michael-Knoevenagel-hetero-Diels-Alder reactions: an efficient asymmetric one-pot strategy to isochromene pyrimidinedione derivatives.
Organic letters, 2012, 14, 448-451
1503561 CIFC13 H14 N2 O2P c a 2116.7103; 11.6052; 12.5938
90; 90; 90		2442.3Mahanta, Sanjeev P.; Kumar, B. Sathish; Baskaran, Sambath; Sivasankar, Chinnappan; Panda, Pradeepta K.
Colorimetric sensing of fluoride ion by new expanded calix[4]pyrrole through anion-π interaction.
Organic letters, 2012, 14, 548-551
1503649 CIFC22 H17 N O SP c a 2128.2746; 7.6602; 7.6661
90; 90; 90		1660.39Wang, Xiang-Shan; Li, Qing; Wu, Jian-Rong; Tu, Shu-Jiang
Efficient Method for the Synthesis of Pyranoquinoline, Thiopyranoquinoline, Thienoquinoline, and Naphtho[2,7]naphthyridine Derivatives Catalyzed by Iodine
Journal of Combinatorial Chemistry, 2009, 11, 433
1503662 CIFC14 H13 N O3 S2P c a 2113.516; 9.108; 22.558
90; 90; 90		2777Agrawal, Arpita; de Oliveira, César Augusto F; Cheng, Yuhui; Jacobsen, Jennifer A.; McCammon, J. Andrew; Cohen, Seth M.
Thioamide hydroxypyrothiones supersede amide hydroxypyrothiones in potency against anthrax lethal factor.
Journal of medicinal chemistry, 2009, 52, 1063-1074
1503897 CIFC11 H18 N4 O2P c a 219.7231; 9.0749; 13.0834
90; 90; 90		1154.43Kelly, Ann Rowley; Wei, Jingqiang; Kesavan, Sarathy; Marié, Jean-Charles; Windmon, Nicole; Young, Damian W.; Marcaurelle, Lisa A.
Accessing skeletal diversity using catalyst control: formation of n and n + 1 macrocyclic triazole rings.
Organic letters, 2009, 11, 2257-2260
1503906 CIFC28 H30 O4P c a 2124.138; 8.8059; 10.177
90; 90; 90		2163.2Mitasev, Branko; Porco, Jr, John A
Manganese(III)-mediated transformations of phloroglucinols: a formal oxidative [4 + 2] cycloaddition leading to bicyclo[2.2.2]octadiones.
Organic letters, 2009, 11, 2285-2288
1503974 CIFC20 H22 O5P c a 2112.306; 12.827; 10.576
90; 90; 90		1669.4Majetich, George; Grove, Jeremy L.
Total synthesis of (+)-19-deoxyicetexone, (-)-icetexone, and (+)-5-epi-icetexone.
Organic letters, 2009, 11, 2904-2907
1504040 CIFC14 H11 IP c a 2126.395; 12.0508; 7.482
90; 90; 90		2379.9Pawluć, Piotr; Hreczycho, Grzegorz; Szudkowska, Justyna; Kubicki, Maciej; Marciniec, Bogdan
New one-pot synthesis of (E)-beta-aryl vinyl halides from styrenes.
Organic letters, 2009, 11, 3390-3393
1504479 CIFC24 H27 N O4P c a 2111.147; 18.976; 9.467
90; 90; 90		2002.5Taniguchi, Tsuyoshi; Tanabe, Genzo; Muraoka, Osamu; Ishibashi, Hiroyuki
Total synthesis of (+/-)-stemonamide and (+/-)-isostemonamide using a radical cascade.
Organic letters, 2008, 10, 197-199
1505089 CIFC7 H13 I N2 OP c a 2115.2411; 8.2598; 32.681
90; 90; 90		4114.2Fei, Zhaofu; Ang, Wee Han; Zhao, Dongbin; Scopelliti, Rosario; Zvereva, Elena E.; Katsyuba, Sergey A.; Dyson, Paul J.
Revisiting ether-derivatized imidazolium-based ionic liquids.
The journal of physical chemistry. B, 2007, 111, 10095-10108
1505271 CIFC48 H60 O8 S4P c a 2118.5095; 11.1086; 22.85
90; 90; 90		4698.3Lee, Jai Young; Kwon, Jongchul; Park, Chul Soon; Lee, Ji-Eun; Sim, Wonbo; Kim, Jong Seung; Seo, Joobeom; Yoon, Il; Jung, Jong Hwa; Lee, Shim Sung
Calix[4]thiacrowns as ditopic hosts for homo- and heterobinuclear accommodation: first report of a chopsticks-type pi-coordination.
Organic letters, 2007, 9, 493-496
1506234 CIFC13 H16 O2P c a 2111.2356; 5.4389; 19.1892
90; 90; 90		1172.64Jervis, Peter J.; Kariuki, Benson M.; Cox, Liam R.
Stereoselective synthesis of 2,4,5-trisubstituted tetrahydropyrans using an intramolecular allylation strategy.
Organic letters, 2006, 8, 4649-4652
1506335 CIFC7 H15 Cu N O6P c a 2119.837; 7.084; 14.896
90; 90; 90		2093.3Skorik, Yury A.; Gomes, Carlos A. R.; Podberezskaya, Nina V.; Romanenko, Galina V.; Pinto, Luiz F.; Yatluk, Yury G.
Complexation Models ofN-(2-Carboxyethyl)chitosans with Copper(II) Ions
Biomacromolecules, 2005, 6, 189
1506370 CIFC37 H49 N6 O9P c a 2114.77; 20.689; 12.699
90; 90; 90		3881Maekawa, Kensuke; Shiomi, Daisuke; Ise, Tomoaki; Sato, Kazunobu; Takui, Takeji
Exchange interaction in covalently bonded biradical-monoradical composite molecules.
The journal of physical chemistry. B, 2005, 109, 3303-3309
1506496 CIFC26 H16 N4 O12P c a 2112.3501; 18.786; 10.827
90; 90; 90		2512Katz, Jeffrey L.; Feldman, Michael B.; Conry, Rebecca R.
Synthesis of functionalized oxacalix[4]arenes.
Organic letters, 2005, 7, 91-94
1506524 CIFC20 H15 N3 OP c a 2115.686; 12.04; 7.8796
90; 90; 90		1488.1Davis, Riju; Tamaoki, Nobuyuki
Novel photochromic spiroheterocyclic molecules via oxidation of 1,8-diaminonaphthalene.
Organic letters, 2005, 7, 1461-1464
1506666 CIFC7 H7 F2 IP c a 2117.946; 11.4823; 7.3257
90; 90; 90		1509.54Ye, Chengfeng; Twamley, Brendan; Shreeve, Jean'ne M.
Straightforward syntheses of hypervalent iodine(III) reagents mediated by Selectfluor.
Organic letters, 2005, 7, 3961-3964
1506681 CIFC88 H76 Cl12 N6 O6P c a 2133.749; 12.982; 19.167
90; 90; 90		8398Tominaga, Masahide; Masu, Hyuma; Katagiri, Kosuke; Kato, Takako; Azumaya, Isao
Triple helicate constructed by covalent bondings: crystal structure and effective synthesis based on propeller-like substructures.
Organic letters, 2005, 7, 3785-3787
1506741 CIFC18 H26 Cl2 N2 O2P c a 2114.174; 11.5857; 12.0325
90; 90; 90		1975.9Lim, Yeon-Hee; Li, Tindy; Chen, Peiling; Schreiber, Patrick; Kuznetsova, Larissa; Carroll, Patrick J.; Lauher, Joseph W.; Sieburth, Scott McN
Asymmetry by electrophilic rearrangement of symmetric 2-pyridone photodimers.
Organic letters, 2005, 7, 5413-5415
1506809 CIFC18 H19 N4 O2P c a 2113.515; 11.858; 10.593
90; 90; 90		1697.6Nagashima, Hideaki; Inoue, Hidenari; Yoshioka, Naoki
An Ideal One-Dimensional Antiferromagnetic Spin System Observed in Hydrogen-Bonded Naphth[2,3-d]imidazol-2-yl Nitronyl Nitroxide Crystal: The Role of the Hydrogen Bond.
The journal of physical chemistry. B, 2004, 108, 6144-6151
1507057 CIFC7 H8 O S2P c a 2111.134; 6.498; 10.429
90; 90; 90		754.52Ishii, Akihiko; Kashiura, Satoshi; Oshida, Hideaki; Nakayama, Juzo
First isolation of eclipsed vic-disulfoxide: 7,8-dithiabicyclo[4.2.1]nona-2,4-diene 7-exo,8-exo-dioxide.
Organic letters, 2004, 6, 2623-2626
1507058 CIFC7 H8 O2 S2P c a 2119.794; 6.216; 12.889
90; 90; 90		1585.9Ishii, Akihiko; Kashiura, Satoshi; Oshida, Hideaki; Nakayama, Juzo
First isolation of eclipsed vic-disulfoxide: 7,8-dithiabicyclo[4.2.1]nona-2,4-diene 7-exo,8-exo-dioxide.
Organic letters, 2004, 6, 2623-2626
1507788 CIFC10 H15 N3 O5 PtP c a 219.4898; 15.218; 8.9436
90; 90; 90		1291.6Wilson, Justin J.; Lippard, Stephen J.
In Vitro Anticancer Activity of cis-Diammineplatinum(II) Complexes with β-Diketonate Leaving Group Ligands.
Journal of medicinal chemistry, 2012, 55, 5326-5336
1507848 CIFC17 H15 Br O4P c a 2110.86; 17.451; 8.049
90; 90; 90		1525.4Parnes, Regev; Kshirsagar, Umesh A.; Werbeloff, Aviya; Regev, Clil; Pappo, Doron
Ligand-controlled iron-catalyzed coupling of α-substituted β-ketoesters with phenols.
Organic letters, 2012, 14, 3324-3327
1507879 CIFC27 H21 N S3P c a 2115.2379; 14.5654; 19.8667
90; 90; 90		4409.3Sathyamoorthi, Shyam; Mague, Joel T.; Pascal, Jr, Robert A
An in-triphenylaminophane.
Organic letters, 2012, 14, 3427-3429
1508023 CIFC81 H84 F24 N17 O P4 V2P c a 2123.4395; 21.7426; 17.4435
90; 90; 90		8889.8Bechlars, Bettina; D'Alessandro, Deanna M; Jenkins, David M.; Iavarone, Anthony T.; Glover, Starla D.; Kubiak, Clifford P.; Long, Jeffrey R.
High-spin ground states via electron delocalization in mixed-valence imidazolate-bridged divanadium complexes.
Nature chemistry, 2010, 2, 362-368
1508241 CIFC76 H107 B O4 U2P c a 2124.882; 10.719; 25.2792
90; 90; 90		6742.22Arnold, Polly L.; Mansell, Stephen M.; Maron, Laurent; McKay, David
Spontaneous reduction and C-H borylation of arenes mediated by uranium(III) disproportionation.
Nature chemistry, 2012, 4, 668-674
1508330 CIFC14 H18 O4P c a 2115.563; 5.224; 32.605
90; 90; 90		2651Han, Xun; Floreancig, Paul E.
Synthesis of bridged inside-outside bicyclic ethers through oxidative transannular cyclization reactions.
Organic letters, 2012, 14, 3808-3811
1508341 CIFC22 H27 N7 O7P c a 2120.6019; 7.0886; 32.075
90; 90; 90		4684.2Dyablo, Olga V.; Shmoilova, Elena A.; Pozharskii, Alexander F.; Ozeryanskii, Valery A.; Burov, Oleg N.; Starikova, Zoya A.
4,5-Bis(dimethylamino)quinolines: Proton Sponge versus Azine Behavior.
Organic letters, 2012, 14, 4134-4137
1508519 CIFC25 H26 Fe N2 O2P c a 2119.7267; 5.7377; 36.268
90; 90; 90		4105Patra, Malay; Ingram, Katrin; Pierroz, Vanessa; Ferrari, Stefano; Spingler, Bernhard; Keiser, Jennifer; Gasser, Gilles
Ferrocenyl derivatives of the anthelmintic praziquantel: design, synthesis, and biological evaluation.
Journal of medicinal chemistry, 2012, 55, 8790-8798
1508637 CIFC18 H17 I O3P c a 2114.2621; 16.5312; 6.638
90; 90; 90		1565.04Petrone, David A.; Malik, Hasnain A.; Clemenceau, Antonin; Lautens, Mark
Functionalized chromans and isochromans via a diastereoselective Pd(0)-catalyzed carboiodination.
Organic letters, 2012, 14, 4806-4809
1508667 CIFC92.25 H46P c a 2115.7767; 14.3048; 24.0147
90; 90; 90		5419.7Yanney, Michael; Fronczek, Frank R.; Sygula, Andrzej
Corannulene subunit acts as a diene in a cycloaddition reaction: synthesis of C80H32 corannulyne tetramer.
Organic letters, 2012, 14, 4942-4945
1508736 CIFC18 H18 N2 O2P c a 2115.3122; 15.6051; 6.1644
90; 90; 90		1472.97Wang, Ruomeng; Bojase, Gomotsang; Willis, Anthony C.; Paddon-Row, Michael N; Sherburn, Michael S.
Nitroso-dienophile additions to dendralenes: a short synthesis of branched aminosugars.
Organic letters, 2012, 14, 5652-5655
1508819 CIFC15 H19 Cl N4 O4P c a 2111.6146; 7.7855; 35.607
90; 90; 90		3219.8Ye, Zhenjun; Shi, Lina; Shao, Xusheng; Xu, Xiaoyong; Xu, Zhiping; Li, Zhong
Pyrrole- and dihydropyrrole-fused neonicotinoids: design, synthesis, and insecticidal evaluation.
Journal of agricultural and food chemistry, 2013, 61, 312-319
1509199 CIFAg As O3P c a 2119.488; 6.6; 12.661
90; 90; 90		1628.47Jansen, M.; Curda, J.; Peters, E.M.
Ein Metaarsenat(V) Anion neuartiger Konstitution in Ag As O3
Zeitschrift fuer Anorganische und Allgemeine Chemie, 2004, 630, 491-494
1510695 CIFB2 Ba2 O6 ZnP c a 2115.068; 8.72; 10.128
90; 90; 90		1330.75Smith, R.W.; Koliha, L.J.
A new noncentrosymmetric orthoborate (Ba2 Zn (B O3)2)
Materials Research Bulletin, 1994, 29, 1203-1210
1510892 CIFB3 Ce O6P c a 2118.457; 4.4675; 4.2951
90; 90; 90		354.16Huppertz, H.; Despotopoulou, C.; Emme, H.
High-pressure synthesis and crystal structure of structurally new orthorhombic rare-earth meta-oxoborates gamma-RE (B O2)3 (RE= La - Nd)
Zeitschrift fuer Anorganische und Allgemeine Chemie, 2004, 630, 2450-2457
1511655 CIFB7 Br Ni3 O13P c a 218.5218; 8.5127; 12.0408
90; 90; 90		873.482Svensson, C.; Abrahams, S.C.; Bernstein, J.L.
Orthorhombic phase of nickel bromine boracite Ni3 B7 O13 Br: room temperature ferroelectric- ferroelastic crystal structure
Journal of Chemical Physics, 1981, 75, 1912-1918
1511658 CIFB7 Cl Cr3 O13P c a 218.5647; 8.6125; 12.1453
90; 90; 90		895.88Schmid, H.; Mao, S.Y.; Kubel, F.; Yvon, K.
Powder and single-crystal X-ray study of chromium chlorine boracite, Cr3 B7 O13 Cl, at low temperature. Powder refinement of the orthorhombic modification at 100K
Ferroelectrics, 1992, 132, 239-244
1511665 CIFB7 Co3 I O13P c a 218.6012; 8.5695; 12.1208
90; 90; 90		893.4Clin, M.; Fischer, P.; Schmid, H.; Schobinger, P.
Magnetic phase transition in cobalt iodine boracite
Phase Transition, 1991, 33, 149-157
1511676 CIFB7 I Mn3 O13P c a 218.7603; 8.6936; 12.3466
90; 90; 90		940.299Ritter, C.; Schobinger-Papamantellos, P.; Schmid, H.; Crottaz, O.; Suard, E.; Gentil, S.; Rivera, J.P.
Magnetic ordering of Mn3 B7 O13 X (X = Cl, Br, I) boracites determined by magnetic measurements and neutron diffraction
Ferroelectrics, 1997, 204, 45-55
1511780 CIFC8 H4 D K O4P c a 219.598; 13.32; 6.4599
90; 90; 90		825.9Riley, Erin A.; Hess, Chelsea M.; Pioquinto, Jan Rey L.; Kaminsky, Werner; Kahr, Bart; Reid, Philip J.
Proton transfer and photoluminescence intermittency of single emitters in dyed crystals.
The journal of physical chemistry. B, 2013, 117, 4313-4324
1511781 CIFC8 H4 D K O4P c a 219.6164; 13.3282; 6.4869
90; 90; 90		831.42Riley, Erin A.; Hess, Chelsea M.; Pioquinto, Jan Rey L.; Kaminsky, Werner; Kahr, Bart; Reid, Philip J.
Proton transfer and photoluminescence intermittency of single emitters in dyed crystals.
The journal of physical chemistry. B, 2013, 117, 4313-4324
1511782 CIFC8 H5 K O4P c a 219.5955; 13.2964; 6.4663
90; 90; 90		825.01Riley, Erin A.; Hess, Chelsea M.; Pioquinto, Jan Rey L.; Kaminsky, Werner; Kahr, Bart; Reid, Philip J.
Proton transfer and photoluminescence intermittency of single emitters in dyed crystals.
The journal of physical chemistry. B, 2013, 117, 4313-4324
1511783 CIFC8 H5 K O4P c a 219.6172; 13.3264; 6.4876
90; 90; 90		831.47Riley, Erin A.; Hess, Chelsea M.; Pioquinto, Jan Rey L.; Kaminsky, Werner; Kahr, Bart; Reid, Philip J.
Proton transfer and photoluminescence intermittency of single emitters in dyed crystals.
The journal of physical chemistry. B, 2013, 117, 4313-4324
1511795 CIFC14 H8 O2 S3P c a 2127.724; 3.8968; 11.6473
90; 90; 90		1258.31Zhou, Weidong; Hernández-Burgos, Kenneth; Burkhardt, Stephen E.; Qian, Hualei; Abru Héctor D.
Synthesis and Electrochemical and Computational Analysis of Two New Families of Thiophene-Carbonyl Molecules
The Journal of Physical Chemistry C, 2013, 117, 6022
1512105 CIFC24 H27 N O4 SP c a 2111.3759; 11.6984; 15.9768
90; 90; 90		2126.2Poittevin, Clément; Liautard, Virginie; Beniazza, Redouane; Robert, Frédéric; Landais, Yannick
Free-Radical Carbo-alkenylation of Enamides and Ene-carbamates.
Organic letters, 2013, 15, 2814-2817
1512458 CIFC26 H30 Au2 F6 N2 O6 P2 S2P c a 2112.948; 16.785; 16.495
90; 90; 90		3584.9Manuel Bardaji; Ana B. Miguel-Coello; Pablo Espinet
Mono- and dinuclear luminescent 1,1'-biisoquinoline gold(I) complexes
Inorganica Chimica Acta, 2012, 392, 91-98
1512596 CIFC11 H14 Br2 O TeP c a 2111.1874; 14.775; 8.1374
90; 90; 90		1345.1Conner, Elizabeth S.; Crocker, Katherine E.; Fernando, Ranelka G.; Fronczek, Frank R.; Stanley, George G.; Ragains, Justin R.
Visible-light-promoted selenofunctionalization of alkenes.
Organic letters, 2013, 15, 5558-5561
1512706 CIFC13 H19 Cl2 N Pd SeP c a 217.949; 19.348; 10.049
90; 90; 90		1545.5Pradhumn Singh; Dipanwita Das; Om Prakash; Ajai K. Singh
Synthesis and structural chemistry of N-{2-(arylthio/seleno) ethyl}morpholine/piperidine-palladium(II) complexes as potent catalysts for the Heck reaction
Inorganica Chimica Acta, 2012, 393, 77-84
1513038 CIFC32 H75 Cl16 N8 O8 Zn4P c a 2122.703; 6.9191; 18.637
90; 90; 90		2927.6Lamshöft, Marc; Storp, Jürgen; Ivanova, Bojidarka; Spiteller, Michael
Gas-phase CT-stabilized Ag(I) and Zn(II) metal-organic complexes–experimental vs. theoretical study
Polyhedron, 2011, 30, 2564
1513061 CIFC10 H22 N3 O3P c a 2110.9481; 14.463; 8.0063
90; 90; 90		1267.7Ivanova, Bojidarka; Spiteller, Michael
Heptachloroepoxides - theoretical versus experimental study of the embedded samples in the matrixes of organic crystals
Journal of Inclusion Phenomena and Macrocyclic Chemistry, 2013, 76, 415
1513075 CIFC14 H23 N4 O6P c a 2110.466; 18.241; 8.265
90; 90; 90		1577.9Ivanova, Bojidarka
Solid-state Raman spectra of non-centrosymmetric crystals – theoretical vs. experimental study towards an application in THz-regime
Journal of Molecular Structure, 2012, 1016, 47
1513133 CIFC15 H14 S2P c a 217.5615; 21.1348; 16.2978
90; 90; 90		2604.56Chen, Lei; Mahmoud, Sufian M.; Yin, Xiaodong; Lalancette, Roger A.; Pietrangelo, Agostino
Decreasing Aromaticity in π-Conjugated Materials: Efficient Synthesis and Electronic Structure Identification of Cyclopentadiene-Containing Systems
Organic Letters, 2013, 15, 5970
1513248 CIFC12 H12 N2 OP c a 2114.893; 8.972; 7.742
90; 90; 90		1034.5Markey, Sophie J.; Lewis, William; Moody, Christopher J.
A New Route to α-Carbolines Based on 6π-Electrocyclization of Indole-3-alkenyl Oximes.
Organic letters, 2013, 15, 6306-6308
1513736 CIFC11 H12 F6 Li N O13 S2P c a 218.729; 14.045; 16.041
90; 90; 90		1966.6McOwen, Dennis W.; Seo, Daniel M.; Borodin, Oleg; Vatamanu, Jenel; Boyle, Paul D.; Henderson, Wesley A.
Concentrated electrolytes: decrypting electrolyte properties and reassessing Al corrosion mechanisms
Energy & Environmental Science, 2014, 7, 416
1513790 CIFC17 H16 F6 N3 P RuP c a 2111.1674; 10.4372; 16.4146
90; 90; 90		1913.23Li, Le; Herzon, Seth B.
Temporal separation of catalytic activities allows anti-Markovnikov reductive functionalization of terminal alkynes.
Nature chemistry, 2014, 6, 22-27
1513796 CIFC21 H29 F5 Si3P c a 2119.1914; 10.6017; 23.3513
90; 90; 90		4751.1Inagaki, Yusuke; Nakamoto, Masaaki; Sekiguchi, Akira
A Diels-Alder super diene breaking benzene into C2H2 and C4H4 units.
Nature communications, 2014, 5, 3018
1514404 CIFC14 H9 F6 NP c a 2110.0174; 15.9406; 7.9776
90; 90; 90		1273.89Yin, Haolin; Lewis, Andrew J.; Williams, Ursula J.; Carroll, Patrick J.; Schelter, Eric J.
Fluorinated diarylamide complexes of uranium(iii, iv) incorporating ancillary fluorine-to-uranium dative interactions
Chemical Science, 2013, 4, 798
1514453 CIFC29 H30 O3 SiP c a 2125.2196; 11.8584; 8.5478
90; 90; 90		2556.34Zhao, Jinbo; Liu, Shasha; Marino, Nadia; Clark, Daniel A.
Regio- and stereoselective trans-silylvinylation of internal alkynes catalyzed by RuHCl(CO)(PCy3)2
Chemical Science, 2013, 4, 1547
1514728 CIFC34 H30 Au O4 P S2P c a 2123.574; 11.1504; 23.342
90; 90; 90		6135.7Scheetz, Kolbe J.; Spaeth, Andrew D.; Vorushilov, Alexander S.; Powell, Douglas R.; Day, Victor W.; Barybin, Mikhail V.
The 2,6-dimercaptoazulene motif: efficient synthesis and completely regioselective metallation of its 6-mercapto terminus
Chemical Science, 2013, 4, 4267
1514860 CIFC19 H16 Au Cl N2P c a 2112.8493; 6.2192; 20.5103
90; 90; 90		1639.03Citta, Anna; Schuh, Esther; Mohr, Fabian; Folda, Alessandra; Massimino, Maria Lina; Bindoli, Alberto; Casini, Angela; Rigobello, Maria Pia
Fluorescent silver(I) and gold(I)-N-heterocyclic carbene complexes with cytotoxic properties: mechanistic insights.
Metallomics : integrated biometal science, 2013, 5, 1006-1015
1515158 CIFC12 H8 O3P c a 2124.2219; 5.1953; 7.4212
90; 90; 90		933.88Fallon, Thomas; Willis, Anthony C.; Rae, A. David; Paddon-Row, Michael N.; Sherburn, Michael S.
β-Oligofurans
Chemical Science, 2012, 3, 2133
1515284 CIFB H12 Li N4P c a 2112.0187; 6.49642; 7.6645
90; 90; 90		598.43He, Teng; Wu, Hui; Wu, Guotao; Wang, Junhu; Zhou, Wei; Xiong, Zhitao; Chen, Juner; Zhang, Tao; Chen, Ping
Borohydride hydrazinates: high hydrogen content materials for hydrogen storage
Energy & Environmental Science, 2012, 5, 5686
1515367 CIFC13 H19 F N2 SP c a 2117.405; 8.732; 17.612
90; 90; 90		2677Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A.
Towards predictable transmembrane transport: QSAR analysis of anion binding and transport
Chemical Science, 2013, 4, 3036
1515449 CIFC18 H21 N O2P c a 2111.93; 8.5702; 30.278
90; 90; 90		3095.7Faustino, Hélio; López, Fernando; Castedo, Luis; Mascareñas, José L.
Gold(i)-catalyzed intermolecular (4 + 2) cycloaddition of allenamides and acyclic dienes
Chemical Science, 2011, 2, 633
1515813 CIFC29 H34 Cl2 F6 N2 O6 Pd2P c a 2133.636; 11.4193; 18.0125
90; 90; 90		6918.6Yeung, Charles S.; Zhao, Xiaodan; Borduas, Nadine; Dong, Vy M.
Pd-catalyzed ortho-arylation of phenylacetamides, benzamides, and anilides with simple arenes using sodium persulfate
Chemical Science, 2010, 1, 331
1515821 CIFC15 H24 Cl2 Cu N3P c a 2111.892; 15.074; 9.64
90; 90; 90		1728Casitas, Alicia; King, Amanda E.; Parella, Teodor; Costas, Miquel; Stahl, Shannon S.; Ribas, Xavi
Direct observation of CuI/CuIII redox steps relevant to Ullmann-type coupling reactions
Chemical Science, 2010, 1, 326
1515822 CIFC15 H24 Br2 Cu N3P c a 2112.3103; 15.3429; 9.6916
90; 90; 90		1830.5Casitas, Alicia; King, Amanda E.; Parella, Teodor; Costas, Miquel; Stahl, Shannon S.; Ribas, Xavi
Direct observation of CuI/CuIII redox steps relevant to Ullmann-type coupling reactions
Chemical Science, 2010, 1, 326
1515824 CIFC14 H24 Cl2 Cu N3 OP c a 2112.47; 15.254; 9.07
90; 90; 90		1725.3Casitas, Alicia; King, Amanda E.; Parella, Teodor; Costas, Miquel; Stahl, Shannon S.; Ribas, Xavi
Direct observation of CuI/CuIII redox steps relevant to Ullmann-type coupling reactions
Chemical Science, 2010, 1, 326
1515980 CIFC36 H44 N4 O4P c a 2125.739; 9.667; 12.857
90; 90; 90		3199Dethe, Dattatraya H.; Erande, Rohan D.; Dherange, Balu D.
Remarkable switch of regioselectivity in diels-alder reaction: divergent total synthesis of borreverine, caulindoles, and flinderoles.
Organic letters, 2014, 16, 2764-2767
1515990 CIFC27 H27 N3 O3P c a 2117.384; 9.096; 28.177
90; 90; 90		4455Culf, Adrian S.; Cuperlović-Culf, Miroslava; Léger, Daniel A; Decken, Andreas
Small Head-to-Tail Macrocyclic α-Peptoids.
Organic letters, 2014, 16, 2780-2783
1516133 CIFC20 H4 Br4 Cl4P c a 217.4442; 27.2175; 19.194
90; 90; 90		3888.9Zagranyarski, Yulian; Chen, Long; Jänsch, Daniel; Gessner, Thomas; Li, Chen; Müllen, Klaus
Toward perylene dyes by the hundsdiecker reaction.
Organic letters, 2014, 16, 2814-2817
1516374 CIFC22 H32 N4 O6P c a 217.6093; 18.2086; 17.2841
90; 90; 90		2394.8Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi
New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking.
The journal of physical chemistry. A, 2009, 113, 11354-11366
1516637 CIFC5 H5 Br2 NP c a 2114.273; 4.6009; 10.7534
90; 90; 90		706.16Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan
The nature of halogen...halide synthons: theoretical and crystallographic studies.
The journal of physical chemistry. A, 2007, 111, 2319-2328
1516638 CIFC5 H5 Br Cl NP c a 2114.274; 4.4396; 10.581
90; 90; 90		670.5Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan
The nature of halogen...halide synthons: theoretical and crystallographic studies.
The journal of physical chemistry. A, 2007, 111, 2319-2328
1516639 CIFC5 H5 Br I NP c a 2114.2891; 4.8298; 10.9546
90; 90; 90		756.02Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan
The nature of halogen...halide synthons: theoretical and crystallographic studies.
The journal of physical chemistry. A, 2007, 111, 2319-2328
1516673 CIFC18 H8 O2 SP c a 2115.913; 11.398; 6.921
90; 90; 90		1255.3Rudebusch, Gabriel E.; Fix, Aaron G.; Henthorn, Hillary A.; Vonnegut, Chris L.; Zakharov, Lev N.; Haley, Michael M.
Quinoidal diindenothienoacenes: synthesis and properties of new functional organic materials
Chemical Science, 2014, 5, 3627
1516814 CIFC18 H16 N2 O3P c a 2128.94; 5.9109; 9.179
90; 90; 90		1570.2Gould, Eoin; Walden, Daniel M.; Kasten, Kevin; Johnston, Ryne C.; Wu, Jiufeng; Slawin, Alexandra M. Z.; Mustard, Thomas J. L.; Johnston, Brittany; Davies, Tony; Ha-Yeon Cheong, Paul; Smith, Andrew D.
Catalyst selective and regiodivergent O- to C- or N-carboxyl transfer of pyrazolyl carbonates: synthetic and computational studies
Chemical Science, 2014, 5, 3651
1516893 CIFC58 H86 O3 Si4 U2P c a 2143.8503; 10.3313; 24.2758
90; 90; 90		10997.7Tsoureas, Nikolaos; Castro, Ludovic; Kilpatrick, Alexander F. R.; Cloke, F. Geoffey N.; Maron, Laurent
Controlling selectivity in the reductive activation of CO2 by mixed sandwich uranium(iii) complexes
Chemical Science, 2014, 5, 3777
1516941 CIFC113 H116 Cu9 N28 O21P c a 2133.552; 11.631; 30.295
90; 90; 90		11822Dongcheng Liu; Zilu Chen; Wanyun Huang; Suni Qin; Liping Jiang; Suping Zhou; Fupei Liang
Metal clusters constructed by dihydrazide ligand: Synthesis, structure and magnetic properties
Inorganica Chimica Acta, 2013, 400, 179-183
1516962 CIFC11 H19 N Ni O8P c a 2111.3509; 16.7012; 7.4757
90; 90; 90		1417.2Smrečki, Neven; Kukovec, Boris-Marko; Đaković, Marijana; Popović, Zora
Nickel(II) complexes with N‒aralkyliminodiacetic acids: preparation, spectroscopic, structural and thermal characterization
Inorganica Chimica Acta, 2013, 400, 122-129

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