Crystallography Open Database

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1503481 CIFC30 H26 N6C 1 2/c 126.6002; 12.4004; 17.7239
90; 120.646; 90
5029.8Chiu, Melanie; Jaun, Bernhard; Beels, Marten T. R.; Biaggio, Ivan; Gisselbrecht, Jean-Paul; Boudon, Corinne; Schweizer, W. Bernd; Kivala, Milan; Diederich, François
N,N'-Dicyanoquinone diimide-derived donor-acceptor chromophores: conformational analysis and optoelectronic properties.
Organic letters, 2012, 14, 54-57
1503543 CIFC10 H6 N2 S2C 1 2/c 112.3446; 7.2892; 10.3201
90; 105.901; 90
893.09Benniston, Andrew C.; Hagon, Jerry; He, Xiaoyan; Yang, Songjie; Harrington, Ross W.
Spring open two-plus-two electron storage in a disulfide-strapped methyl viologen derivative.
Organic letters, 2012, 14, 506-509
1503632 CIFC46 H48 F14 N4 O4 Os P2C 1 2/c 144.415; 10.361; 27.44
90; 127.384; 90
10033.6Carlson, Brenden; Bullock, John P.; Hance, Timothy M.; Phelan, Gregory D.
Barometric sensitive coatings based upon osmium complexes dissolved in a fluoroacrylic polymer
Analytical chemistry, 2009, 81, 262-267
1503633 CIFC24 H19 F3 N5 O9 ReC 1 2/c 119.0902; 14.6852; 20.6888
90; 100.591; 90
5701.2He, Haiyang; Morely, Jennifer E.; Silva-Lopez, Elsa; Bottenus, Brienne; Montajano, Maribel; Fugate, Glenn A.; Twamley, Brendan; Benny, Paul D.
Synthesis and characterization of nonsteroidal-linked M(CO)(3)+ (M = 99mTc, Re) compounds based on the androgen receptor targeting molecule flutamide.
Bioconjugate chemistry, 2009, 20, 78-86
1503655 CIFC24 H27 N5 O3C 1 2/c 130.9404; 9.1578; 16.8812
90; 99.108; 90
4722.91Wang, Xiang-Shan; Wu, Jian-Rong; Zhou, Jie; Tu, Shu-Jiang
Green Method for the Synthesis of Highly Substituted Cyclohexa-1,3-diene, Polyhydroindene, Polyhydronaphthalene, Isochromene, Isothiochromene, and Isoquinoline Derivatives in Ionic Liquids
Journal of Combinatorial Chemistry, 2009, 11, 1011
1503673 CIFC28 H46 Fe2 N22 O13 S4C 1 2/c 19.2033; 23.0998; 21.2104
90; 92.473; 90
4505Kowol, Christian R.; Trondl, Robert; Heffeter, Petra; Arion, Vladimir B.; Jakupec, Michael A.; Roller, Alexander; Galanski, Markus; Berger, Walter; Keppler, Bernhard K.
Impact of metal coordination on cytotoxicity of 3-aminopyridine-2-carboxaldehyde thiosemicarbazone (triapine) and novel insights into terminal dimethylation.
Journal of medicinal chemistry, 2009, 52, 5032-5043
1503807 CIFC13 H14 O2C 1 2/c 118.7028; 5.9021; 20.868
90; 106.022; 90
2214.1Marx, Vanessa M.; Burnell, D. Jean
Synthesis of 5-hydroxycyclopent-2-enones from allenyl vinyl ketones via an interrupted Nazarov cyclization.
Organic letters, 2009, 11, 1229-1231
1503816 CIFC46.75 H46.5 N2 O3.25C 1 2/c 133.5318; 19.5054; 11.6487
90; 95.141; 90
7588.2Dane, Eric L.; Maly, Thorsten; Debelouchina, Galia T.; Griffin, Robert G.; Swager, Timothy M.
Synthesis of a BDPA-TEMPO biradical.
Organic letters, 2009, 11, 1871-1874
1503843 CIFC29 H39 F3 N2 O3 SC 1 2/c 136.619; 7.7648; 20.354
90; 101.835; 90
5664.4Paderes, Monissa C.; Chemler, Sherry R.
Diastereoselective pyrrolidine synthesis via copper promoted intramolecular aminooxygenation of alkenes: formal synthesis of (+)-monomorine.
Organic letters, 2009, 11, 1915-1918
1503915 CIFC17 H17 N O2C 1 2/c 132.886; 6.0205; 14.9007
90; 109.973; 90
2772.7Donohoe, Timothy J.; Callens, Cedric K. A.; Thompson, Amber L.
Tethered aminohydroxylation (TA) reaction of amides.
Organic letters, 2009, 11, 2305-2307
1503917 CIFC9 H15 N O2C 1 2/c 118.3496; 9.3578; 11.8645
90; 120.022; 90
1763.94Donohoe, Timothy J.; Callens, Cedric K. A.; Thompson, Amber L.
Tethered aminohydroxylation (TA) reaction of amides.
Organic letters, 2009, 11, 2305-2307
1503945 CIFC25 H22 O6C 1 2/c 138.18; 8.344; 14.4486
90; 108.287; 90
4370.5Wang, Kung K.; Wang, Yu-Hsuan; Yang, Hua; Akhmedov, Novruz G.; Petersen, Jeffrey L.
Synthesis of a C(56)H(40) hydrocarbon bearing a 54-carbon framework of C(60).
Organic letters, 2009, 11, 2527-2530
1503954 CIFC18 H20 N2 O2C 1 2/c 120.4836; 4.609; 15.63
90; 97.35; 90
1463.49Xiao, Jian; Loh, Teck-Peng
Design, synthesis and optical resolution of new bifunctional ligand: 1,1'-dimethyl-octahydro-8,8'-biquinoline-7,7'-diol.
Organic letters, 2009, 11, 2876-2879
1503992 CIFC36 H29 N O2 SC 1 2/c 121.5239; 10.7271; 26.8898
90; 113.017; 90
5714.3Wang, Shaoyin; Zhu, Yuanxun; Wang, Yanguang; Lu, Ping
Synthesis of functionalized indenes via cascade reaction of aziridines and propargyl alcohols.
Organic letters, 2009, 11, 2615-2618
1504049 CIFC42 H42 N6 O5C 1 2/c 124.171; 9.0645; 19.641
90; 123.943; 90
3570Li, Guo-You; Yang, Tao; Luo, Ying-Gang; Chen, Xiao-Zhen; Fang, Dong-Mei; Zhang, Guo-Lin
Brevianamide J, a new indole alkaloid dimer from fungus Aspergillus versicolor.
Organic letters, 2009, 11, 3714-3717
1504078 CIFC26.52 H48.95 N8.26 O13.48 SC 1 2/c 121.0704; 8.8723; 20.4017
90; 121.08; 90
3266.5Kang, Sung Ok; Day, Victor W.; Bowman-James, Kristin
The influence of amine functionalities on anion binding in polyamide-containing macrocycles.
Organic letters, 2009, 11, 3654-3657
1504112 CIFC73 H105.74 F24 N40 Na3.33 O56.53C 1 2/c 151.867; 16.796; 36.2025
90; 124.185; 90
26089.2Huang, Wei-Hao; Zavalij, Peter Y.; Isaacs, Lyle
Metal-ion-induced folding and dimerization of a glycoluril decamer in water.
Organic letters, 2009, 11, 3918-3921
1504117 CIFC20 H16 N2 O4 S2C 1 2/c 132.3486; 7.7362; 18.9463
90; 124.921; 90
3887.7Palsuledesai, Charuta C.; Murru, Siva; Sahoo, Santosh K.; Patel, Bhisma K.
Acyl-isothiocyanates as efficient thiocyanate transfer reagents.
Organic letters, 2009, 11, 3382-3385
1504126 CIFC24 H12C 1 2/c 119.932; 11.06; 15.993
90; 125.953; 90
2854Umeda, Rui; Hibi, Daijiro; Miki, Koji; Tobe, Yoshito
Tetradehydrodinaphtho[10]annulene: a hitherto unknown dehydroannulene and a viable precursor to stable zethrene derivatives.
Organic letters, 2009, 11, 4104-4106
1504201 CIFC28.5 H31 ClC 1 2/c 125.9973; 12.3802; 13.8796
90; 93.724; 90
4457.74Modjewski, Matthew; Lindeman, Sergey V.; Rathore, Rajendra
A versatile preparation of Geländer-type p-terphenyls from a readily available diacetylenic precursor.
Organic letters, 2009, 11, 4656-4659
1504221 CIFC29 H22 O2C 1 2/c 125.5017; 10.0101; 18.5411
90; 118.749; 90
4149.6Zhang, Xiaoxiang; Teo, Wan Teng; Chan, Philip Wai Hong
Ytterbium(III) triflate catalyzed tandem Friedel-Crafts alkylation/hydroarylation of propargylic alcohols with phenols as an expedient route to indenols.
Organic letters, 2009, 11, 4990-4993
1504252 CIFC18 H9 N4C 1 2/c 128.707; 6.806; 17.534
90; 119.49; 90
2982Lee, Sanghee; Park, Seung Bum
An efficient one-step synthesis of heterobiaryl pyrazolo[3,4-b]pyridines via indole ring opening.
Organic letters, 2009, 11, 5214-5217
1504262 CIFC60 H40C 1 2/c 125.789; 10.154; 15.75
90; 112.458; 90
3812Mahlokozera, Tatenda; Goods, John B.; Childs, Adam M.; Thamattoor, Dasan M.
Crystal structure of a cyclotetramer from a strained cyclic allene.
Organic letters, 2009, 11, 5095-5097
1504274 CIFC10 H10 Cl2 N10 OC 1 2/c 126.903; 19.366; 27.68
90; 112.55; 90
13319Xue, Min; Chen, Chuan-Feng
Triptycene-derived N(H)-bridged azacalixarenes: synthesis, structure, and encapsulation of small neutral molecules in the solid state.
Organic letters, 2009, 11, 5294-5297
1504275 CIFC59.27 H41.16 Cl3.61 N8 O9.57C 1 2/c 124.262; 27.241; 16.704
90; 102.147; 90
10793Xue, Min; Chen, Chuan-Feng
Triptycene-derived N(H)-bridged azacalixarenes: synthesis, structure, and encapsulation of small neutral molecules in the solid state.
Organic letters, 2009, 11, 5294-5297
1504297 CIFC16 H11 N3 O3C 1 2/c 121.754; 8.501; 14.483
90; 102.299; 90
2616.9Yi, Chenyi; Liu, Shi-Xia; Neels, Antonia; Renaud, Philippe; Decurtins, Silvio
Preparation of zwitterionic hydroquinone-fused [1,4]oxazinium derivatives via a photoinduced intramolecular dehydrogenative-coupling reaction.
Organic letters, 2009, 11, 5530-5533
1504317 CIFC9 H9 N O3C 1 2/c 116.038; 14.67; 15.634
90; 116.362; 90
3296Hansen, Marvin M.; Borders, Sandra S. K.; Clayton, Marcella T.; Heath, Perry C.; Kolis, Stanley P.; Larsen, Samuel D.; Linder, Ryan J.; Reutzel-Edens, Susan M.; Smith, Justin C.; Tameze, Shella L.; Ward, Jeffrey A.; Weigel, Leland O.
Development of a Practical Synthesis of an Aminoindanol-Derived M1 Agonist†
Organic Process Research & Development, 2009, 13, 198
1504321 CIFC11 H15 N OC 1 2/c 142.887; 5.1367; 19.263
90; 108.372; 90
4027.3Hursthouse, Michael B.; Huth, L. Susanne; Threlfall, Terence L.
Why Do Organic Compounds Crystallise Well or Badly or Ever so Slowly? Why Is Crystallisation Nevertheless Such a Good Purification Technique?†
Organic Process Research & Development, 2009, 13, 1231
1504365 CIFC49 H34 N2 OC 1 2/c 115.8751; 12.3295; 42.907
90; 93.705; 90
8380.7Liu, Y.; Tao, X.; Wang, F.; Dang, X.; Zou, D.; Ren, Y.; Jiang, M.
Aggregation-Induced Emissions of Fluorenonearylamine Derivatives: A New Kind of Materials for Nondoped Red Organic Light-Emitting Diodes
Journal of Physical Chemistry C, 2008, 112, 3975
1504377 CIFC4 H8 N2 S2C 1 2/c 112.1589; 4.788; 10.7556
90; 102.048; 90
612.36Bushmarinov, Ivan S.; Antipin, Mikhail Yu; Akhmetova, Vnira R.; Nadyrgulova, Guzel R.; Lyssenko, Konstantin A.
Stereoelectronic effects in N-C-S and N-N-C systems: experimental and ab initio AIM study.
The journal of physical chemistry. A, 2008, 112, 5017-5023
1504414 CIFC17 H13 F3 N2 O3 S5C 1 2/c 121.068; 14.014; 14.368
90; 106.74; 90
4062.3Yu, Lei; Zhu, Qin-Yu; Zhang, Yong; Lei, Zhi-Xin; Niu, Gai-Yan; Dai, Jie
Proton effects on diazafluorene derivatives with sulfur-rich substituents, a structural, spectroscopic and theoretical study.
The journal of physical chemistry. A, 2008, 112, 13672-13678
1504421 CIFC38.5 H50.5 Ho N2 Si2C 1 2/c 137.866; 11.041; 20.5883
90; 117.228; 90
7653.8Wang, Baoli; Cui, Dongmei; Lv, Kui
Highly 3,4-Selective Living Polymerization of Isoprene with Rare Earth Metal Fluorenyl N-Heterocyclic Carbene Precursors
Macromolecules, 2008, 41, 1983
1504422 CIFC38.5 H51 Lu N2 Si2C 1 2/c 137.901; 11.0382; 20.4629
90; 117.162; 90
7616.7Wang, Baoli; Cui, Dongmei; Lv, Kui
Highly 3,4-Selective Living Polymerization of Isoprene with Rare Earth Metal Fluorenyl N-Heterocyclic Carbene Precursors
Macromolecules, 2008, 41, 1983
1504423 CIFC38.5 H51 N2 Sc Si2C 1 2/c 137.871; 11.0322; 20.2313
90; 117; 90
7531.4Wang, Baoli; Cui, Dongmei; Lv, Kui
Highly 3,4-Selective Living Polymerization of Isoprene with Rare Earth Metal Fluorenyl N-Heterocyclic Carbene Precursors
Macromolecules, 2008, 41, 1983
1504437 CIFC18 H26 Br2 N2 SC 1 2/c 125.996; 10.36; 7.8366
90; 103.12; 90
2055.4Wen, Li; Duck, Benjamin C.; Dastoor, Paul C.; Rasmussen, Seth C.
Poly(2,3-dihexylthieno[3,4-b]pyrazine) via GRIM Polymerization: Simple Preparation of a Solution Processable, Low-Band-Gap Conjugated Polymer
Macromolecules, 2008, 41, 4576
1504477 CIFC27 H22 O SC 1 2/c 140.402; 5.9938; 18.1842
90; 111.421; 90
4099.3Yamashita, Fumikazu; Kuniyasu, Hitoshi; Terao, Jun; Kambe, Nobuaki
Platinum-catalyzed regio- and stereoselective arylthiolation of internal alkynes.
Organic letters, 2008, 10, 101-104
1504497 CIFC76 H98 N20 O50 Pd2C 1 2/c 132.6438; 10.0301; 29.2548
90; 106.329; 90
9192.3Blanco, Víctor; Chas, Marcos; Abella, Dolores; Pía, Elena; Platas-Iglesias, Carlos; Peinador, Carlos; Quintela, José M
Self-assembly of 1:2 inclusion complexes between a metallocycle host and dihydroxyaromatic guests: a redox controlled complexation process.
Organic letters, 2008, 10, 409-412
1504536 CIFC21 H2 F6 O6 S3C 1 2/c 129.607; 13.304; 17.539
90; 113.503; 90
6335.3Ie, Yutaka; Umemoto, Yoshikazu; Okabe, Makoto; Kusunoki, Takahiro; Nakayama, Ken-ichi; Pu, Yong-Jin; Kido, Junji; Tada, Hirokazu; Aso, Yoshio
Electronegative oligothiophenes based on difluorodioxocyclopentene-annelated thiophenes: synthesis, properties, and n-type FET performances.
Organic letters, 2008, 10, 833-836
1504561 CIFC24 H15 N OC 1 2/c 115.729; 7.122; 28.174
90; 91.872; 90
3154Kawaguchi, Keiko; Nakano, Koji; Nozaki, Kyoko
Synthesis, structures, and properties of unsymmetrical heteroacenes containing both pyrrole and furan rings.
Organic letters, 2008, 10, 1199-1202
1504574 CIFC42 H54 O10C 1 2/c 120.45; 12.501; 19.027
90; 125.3; 90
3970Troisi, Francesco; Citro, Lucia; Gaeta, Carmine; Gavuzzo, Enrico; Neri, Placido
Oxyfunctionalization of calixarene quinone rings
Organic Letters, 2008, 10, 1393-1396
1504644 CIFC108 H98 I4 N4 O8C 1 2/c 135.341; 14.3173; 29.323
90; 120.923; 90
12728Shi, Yubai; Qian, Hualei; Li, Yan; Yue, Wan; Wang, Zhaohui
Copper-mediated domino process for the synthesis of tetraiodinated di(perylene bisimide).
Organic letters, 2008, 10, 2337-2340
1504648 CIFC29 H29 N3C 1 2/c 125.18; 6.0388; 30.338
90; 104.905; 90
4458Gaddam, Vikram; Nagarajan, Rajagopal
An Efficient, one-pot synthesis of isomeric ellipticine derivatives through intramolecular imino-Diels-Alder reaction
Organic Letters, 2008, 10, 1975-1978
1504649 CIFC29 H28 Cl N3C 1 2/c 121.572; 10.274; 21.695
90; 100.722; 90
4724Gaddam, Vikram; Nagarajan, Rajagopal
An Efficient, one-pot synthesis of isomeric ellipticine derivatives through intramolecular imino-Diels-Alder reaction
Organic Letters, 2008, 10, 1975-1978
1504702 CIFC39 H55 O9.5C 1 2/c 131.1124; 17.8789; 14.6484
90; 108.937; 90
7707.2Abe, Hajime; Horii, Asuka; Matsumoto, Shinya; Shiro, Motoo; Inouye, Masahiko
D3h-symmetrical hydrogen-bonding unit as a saccharide recognition and self-assembling module.
Organic letters, 2008, 10, 2685-2688
1504719 CIFC100 H116 F21 K N48 O55C 1 2/c 131.0746; 16.9744; 28.0904
90; 97.968; 90
14673.9Huang, Wei-Hao; Zavalij, Peter Y.; Isaacs, Lyle
Folding of long-chain alkanediammonium ions promoted by a cucurbituril derivative.
Organic letters, 2008, 10, 2577-2580
1504740 CIFC16 H17 N O4C 1 2/c 124.1585; 9.1995; 15.4967
90; 120.19; 90
2976.9Chen, Jian; Liu, Qiang; Zhang, Weicheng; Spinella, Stephen; Lei, Aiwen; Zhang, Xumu
A convenient synthesis and the asymmetric hydrogenation of N-phthaloyl dehydroamino acid esters.
Organic letters, 2008, 10, 3033-3036
1504748 CIFC27 H29 B F2 N2 O2 S2C 1 2/c 118.575; 9.0099; 30.916
90; 104.86; 90
5001Maeda, Hiromitsu; Mihashi, Yuta; Haketa, Yohei
Heteroaryl-substituted C3-bridged oligopyrroles: potential building subunits of anion-responsive pi-conjugated oligomers.
Organic letters, 2008, 10, 3179-3182
1504763 CIFC23 H27 N O5 SC 1 2/c 121.7464; 17.0013; 15.6632
90; 128.378; 90
4539.7Clarke, Paul A.; Zaytsev, Andrey V.; Morgan, Tyson W.; Whitwood, Adrian C.; Wilson, Claire
One-pot synthesis of functionalized piperid-4-ones: a four-component condensation.
Organic letters, 2008, 10, 2877-2880
1504766 CIFC54 H51 N3 O3C 1 2/c 156.489; 10.027; 32.895
90; 91.584; 90
18625Yokoyama, Akihiro; Maruyama, Takurou; Tagami, Kei; Masu, Hyuma; Katagiri, Kosuke; Azumaya, Isao; Yokozawa, Tsutomu
One-pot synthesis of cyclic triamides with a triangular cavity from trans-stilbene and diphenylacetylene monomers.
Organic letters, 2008, 10, 3207-3210
1504803 CIFC29 H24 Ag Cl N2 O2C 1 2/c 120.2507; 14.73; 17.8733
90; 111.846; 90
4948.6Ogle, James W.; Zhang, Jubo; Reibenspies, Joseph H.; Abboud, Khalil A.; Miller, Stephen A.
Synthesis of electronically diverse tetraarylimidazolylidene carbenes via catalytic aldimine coupling.
Organic letters, 2008, 10, 3677-3680

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