Crystallography Open Database

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2104629 CIF
Paper
?; ;
; ;
King, Graham; Garcia-Martin, Susana; Woodward, Patrick M.
Octahedral tilt twinning and compositional modulation in NaLaMgWO~6~
Acta Crystallographica Section B, 2009, 65, 676-683
9013948 CIFBr0.81 Cl1.19 Hg11 I2 O4A -17.0147; 11.8508; 12.5985
115.583; 82.575; 100.619
926.998Cooper, M. A.; Hawthorne, F. C.
The crystal structure of tedhadleyite, Hg2+Hg1+10O4I2(Cl,Br)2. from the Clear Creek Claim, San Benito County, California
Mineralogical Magazine, 2009, 73, 227-234
1504131 CIFC12 H6 O6A b a 210.4174; 37.939; 10.277
90; 90; 90
4061.7Li, Yan; Lampkins, Andrew J.; Baker, Matthew B.; Sumpter, Bobby G.; Huang, Jingsong; Abboud, Khalil A.; Castellano, Ronald K.
Benzotrifuranone: synthesis, structure, and access to polycyclic heteroaromatics.
Organic letters, 2009, 11, 4314-4317
2220929 CIF
HKL
Paper
C26 H18 Br2 N2A b a 215.9691; 8.3482; 16.7767
90; 90; 90
2236.6Dehghanpour, Saeed; Asadizadeh, Saeedeh; Gao, Shan; Ng, Seik Weng
<i>N</i>,<i>N</i>'-Bis(4-bromobenzylidene)biphenyl-2,2'-diamine
Acta Crystallographica Section E, 2009, 65, o306
2221522 CIF
HKL
Paper
C18 H12 N2 OA b a 218.2758; 18.5123; 7.7947
90; 90; 90
2637.16Hassan, Noor Doha; Tajuddin, Hairul Anuar; Abdullah, Zanariah; Ng, Seik Weng
1-Naphthyl quinoxalin-2-yl ether
Acta Crystallographica Section E, 2009, 65, o731
2221975 CIF
HKL
Paper
C38 H40 Fe4 O10A b a 214.599; 19.29; 12.955
90; 90; 90
3648.3Xiao, Yan-Feng; Li, Hong-Feng; Yan, Peng-Fei; Li, Guang-Ming
Bis[μ-1,1'-(ferrocene-1,1'-diyl)bis(butane-1,3-dionato)]di-μ-methanol-diiron(II)
Acta Crystallographica Section E, 2009, 65, m624
2222592 CIF
HKL
Paper
C14 H10 N2 OA b a 213.0119; 22.4944; 7.5355
90; 90; 90
2205.6Shah Bakhtiar, Nasir; Akmam A. Bakar, Maizathul; Abdullah, Zanariah; Ng, Seik Weng
2-(2-Naphthyloxy)pyrimidine
Acta Crystallographica Section E, 2009, 65, o1881
2223367 CIF
HKL
Paper
C18 H20 N4A b a 29.9777; 18.8351; 7.6963
90; 90; 90
1446.37Rivera, Augusto; Maldonado, Mauricio; Ríos-Motta, Jaime; González-Salas, Diego; Dacunha-Marinho, Bruno
2,9-Dimethyl-6<i>H</i>,13<i>H</i>-5:12,7:14-dimethanodibenzo[<i>d</i>,<i>i</i>][1,3,6,8]tetraazecine
Acta Crystallographica Section E, 2009, 65, o2553
2223665 CIF
HKL
Paper
C15 H11 N SA b a 210.7793; 21.26; 10.7244
90; 90; 90
2457.7Tao, Xuquan; Cui, Hui
<i>N</i>-(2-Thienylmethylene)naphthalen-1-amine
Acta Crystallographica Section E, 2009, 65, o2779
4068663 CIFC24 H29 Cl O3 P2 PdA b a 232.473; 17.736; 8.873
90; 90; 90
5110.3Hamada, Adel; Braunstein, Pierre
Palladium Alkyl Complexes Containing β-Phosphonato−Phosphine P,O Ligands and Their Reactivity toward CO-Ethylene or -Acrylate Insertion
Organometallics, 2009, 28, 1688
4069502 CIFC52 H72 Cu4 N4 O4A b a 224.418; 23.1746; 9.4477
90; 90; 90
5346.2Oguadinma, Paul O.; Schaper, Frank
Bis(2-phenylethyl)-nacnac: A Chiral Diketiminate Ligand and Its Copper Complexes
Organometallics, 2009, 28, 4089
4105011 CIFC66 H150 Fe8 N6 O3 S9 Si8A b a 226.522; 28.749; 26.062
90; 90; 90
19872Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi
Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster
Journal of the American Chemical Society, 2009, 131, 13168-13178
4105013 CIFC62 H140 Cl2 Fe8 N6 O2.5 S9 Si8A b a 226.503; 29.012; 26.224
90; 90; 90
20164Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi
Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster
Journal of the American Chemical Society, 2009, 131, 13168-13178
4105014 CIFC64 H144 Br2 Fe8 N6 O3 S9 Si8A b a 226.201; 28.989; 26.46
90; 90; 90
20097Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi
Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster
Journal of the American Chemical Society, 2009, 131, 13168-13178
4509067 CIFC68 H42 Co5 N18 O5A b a 217.9653; 19.8784; 17.6947
90; 90; 90
6319.2Mo, Hao-Jun; Zhong, Yong-Rui; Cao, Man-Li; Ou, Yong-Cong; Ye, Bao-Hui
Hydrothermal Syntheses and Structural Diversity of Cobalt Complexes with 2,2′-Bibenzimidazole Ligand by Temperature Tuning Strategy
Crystal Growth & Design, 2009, 9, 488
4509651 CIFC23 H27 N4 O5 SA b a 213.1383; 27.585; 12.4518
90; 90; 90
4512.8Soegiarto, Airon C.; Ward, Michael D.
Directed Organization of Dye Aggregates in Hydrogen-Bonded Host Frameworks
Crystal Growth & Design, 2009, 9, 3803
4509695 CIFC16 H24 Cd N6 O5A b a 217.212; 13.6942; 18.955
90; 90; 90
4467.8Liang, Xiao-Qiang; Li, Dong-Ping; Zhou, Xin-Hui; Sui, Yan; Li, Yi-Zhi; Zuo, Jing-Lin; You, Xiao-Zeng
Metal−Organic Coordination Polymers Generated from Chiral Camphoric Acid and Flexible Ligands with Different Spacer Lengths: Syntheses, Structures, and Properties
Crystal Growth & Design, 2009, 9, 4872
7001102 CIFC14 H8 N2 O8A b a 29.316; 17.611; 7.964
90; 90; 90
1306.6Dawid, Urszula; Pruchnik, Florian P.; Starosta, Radosław
Structure and properties of 2,2′-bipyridine-3,3′,6,6′-tetracarboxylic acid and its iron(II) and cobalt(II) complexes
Dalton Transactions, 2009, 3348-3353
7002871 CIFC62 H58 B2 N6 RuA b a 216.589; 17.758; 18.439
90; 90; 90
5431.9Zhou, Yan; Xiao, Hong-Ping; Kang, Ling-Chen; Zuo, Jing-Lin; Li, Cheng-Hui; You, Xiao-Zeng
Synthesis and characterization of neutral iron(ii) and ruthenium(ii) complexes with the isocyanotriphenylborate ligand
Dalton Transactions, 2009, 10256-10262
7200497 CIFC30 H28 Cu N6 O8 S6A b a 220.144; 16.6614; 10.5603
90; 90; 90
3544.3Carballo, Rosa; Covelo, Berta; Fernández-Hermida, Nuria; Lago, Ana B.; Vázquez-López, Ezequiel M.
From copper(II) carboxylate to copper(II) 4-pyridylsulfonate coordination polymers as a consequence of the copper(II)-assisted oxidative cleavage of the 4,4'-dipyridyldisulfide ligand
CrystEngComm, 2009, 11, 817-826
7200705 CIFC39 H48 Cl4 N12 O4 Zn2A b a 212.9497; 41.02; 8.8874
90; 90; 90
4721Liang, Jianjun; Wu, Biao; Jia, Chuandong; Yang, Xiao-Juan
Metallomacrocycle or helix: Supramolecular isomerism in bis(pyridylurea) metal complexes
CrystEngComm, 2009, 11, 975
7200706 CIFC40 H50 Cl4 N12 O4 Zn2A b a 212.965; 40.535; 8.8052
90; 90; 90
4627.5Liang, Jianjun; Wu, Biao; Jia, Chuandong; Yang, Xiao-Juan
Metallomacrocycle or helix: Supramolecular isomerism in bis(pyridylurea) metal complexes
CrystEngComm, 2009, 11, 975
4301104 CIFC84 H132 Cu4 N8 O20 P4A e a 217.8321; 26.9021; 19.4751
90; 90; 90
9342.6Ramaswamy Murugavel; Subramaniam Kuppuswamy; Amarendra Nath Maity; Mayank Pratap Singh
Di-, Tri-, Tetra-, and Hexanuclear Copper(II) Mono-organophosphates: Structure and Nuclearity Dependence on the Choice of Phosphorus Substituents and Auxiliary N-Donor Ligands
Inorganic Chemistry, 2009, 48, 183-192
2104488 CIF
Paper
C26 H26 Ga N O2 P2A m a 217.743; 14.8424; 9.6445
90; 90; 90
2539.9Marsh, Richard E.
Space groups <i>P</i>1 and <i>Cc</i>: how are they doing?
Acta Crystallographica Section B, 2009, 65, 782-783
4301658 CIFC25 H28 Cl F3 N3 PA m a 213.7194; 18.513; 9.5476
90; 90; 90
2425Allen T. Ekubo; Mark R. J. Elsegood; Andrew J. Lake; Martin B. Smith
Intramolecular Hydrogen-Bonded Tertiary Phosphines as 1,3,5-Triaza-7-phosphaadamantane (PTA) Analogues
Inorganic Chemistry, 2009, 48, 2633-2638
7001144 CIFC12 H16 Ag Cl2 N5 O3 SA m a 26.579; 27.779; 8.637
90; 90; 90
1578.5Wu, Hua; Dong, Xian-Wu; Ma, Jian-Fang; Liu, Hai-Yan; Yang, Jin; Bai, Hong-Ye
Influence of anionic sulfonate-containing and nitrogen-containing mixed-ligands on the structures of silver coordination polymers
Dalton Transactions, 2009, 3162-3174
2220901 CIF
HKL
Paper
C22 H26 O6 SA m m 219.751; 10.904; 5.092
90; 90; 90
1096.6Yi, Shi-xu; Men, Jian; Wang, Yang; Xiao, Yong; Gao, Guo-wei
2,2'-Dimethyl-4,4'-(sulfonyldi-<i>p</i>-phenylene)dibut-3-yn-2-ol dihydrate
Acta Crystallographica Section E, 2009, 65, o212
9013286 CIFAl4.158 Ca0.492 H46 K0.797 Mg0.069 Na1.981 O45.6 Si13.842A m m a13.6336; 18.2056; 17.8445
90; 90; 90
4429.15Ori, S.; Mazzucato, E.; Vezzalini, G.
Dehydration dynamics of barrerite: An in situ synchrotron XRPD study Note: BAR-A, T = 339 K
American Mineralogist, 2009, 94, 64-73
9013287 CIFAl2.079 Ca0.246 H8.28 K0.398 Mg0.035 Na0.986 O20.38 Si6.921A m m a13.6744; 17.8937; 17.5723
90; 90; 90
4299.69Ori, S.; Mazzucato, E.; Vezzalini, G.
Dehydration dynamics of barrerite: An in situ synchrotron XRPD study Note: BAR-A, T = 482 K
American Mineralogist, 2009, 94, 64-73
9013288 CIFAl4.158 Ca0.498 H12.5 K0.792 Mg0.07 Na1.975 O37.85 Si13.842A m m a13.5502; 17.1487; 16.0919
90; 90; 90
3739.25Ori, S.; Mazzucato, E.; Vezzalini, G.
Dehydration dynamics of barrerite: An in situ synchrotron XRPD study Note: BAR-B, T = 637 K
American Mineralogist, 2009, 94, 64-73
7000498 CIFC60 H81 Cl2 Cr Li N5 O4B -113.7888; 20.6256; 21.5347
93.354; 100.909; 96.853
5950.2Redshaw, Carl; Homden, Damien; Hughes, David L.; Wright, Joseph A.; Elsegood, Mark R. J.
New structural motifs in chromium(iii) calix[4 and 6]arene chemistry
Dalton Transactions, 2009, 1231-1242
1528349 CIFC0.8 H2 B5 Na2.4 O12.4 Sr1.1B 1 1 2/b11.322; 27.182; 6.565
90; 90; 94.66
2013.73Belokoneva, E.L.; Dimitrova, O.V.; Mochenova, N.N.
Synthetic Na,Sr-carbonatoborate with a new type of pentaborate layer: The OD nature of the structure and its correlation with volkovskite, veatchites, and hilgardites
Kristallografiya, 2009, 54, 13-19
9013434 CIFAl0.24 Fe5.6 H6 O18 P3 Zn1.16B b m m13.865; 16.798; 5.151
90; 90; 90
1199.69Elliot, P.; Kolitsch, U.; Giester, G.; Libowitzky, E.; McCammon, C.; Pring, A.; Birch, W. D.; Brugger, J.
Description and crystal structure of a new mineral - plimerite, ZnFe3+4(PO4)3(OH)5 - the Zn-analogue of rockbridgeite and frondelite, from Broken Hill, New South Wales, Australia Locality: Broken Hill, New South Wales, Australia
Mineralogical Magazine, 2009, 73, 131-148
9013650 CIFH4.108 Mn O4.054C -15.1342; 2.8469; 7.4815
90.31; 101.559; 89.944
107.134Lopano, C. L.; Heaney, P. J.; Post, J. E.
Cs-exchange in birnessite: Reaction mechanisms inferred from time-resolved X-ray diffraction and transmission electron microscopy Note: Solution concentration 0.001 M Note: Occupancies of the Oint sites are undetermined, O is used only as a scatterer
American Mineralogist, 2009, 94, 816-826
9013651 CIFH4.344 Mn O4.172C -15.1298; 2.8445; 7.5029
90.12; 101.395; 89.958
107.322Lopano, C. L.; Heaney, P. J.; Post, J. E.
Cs-exchange in birnessite: Reaction mechanisms inferred from time-resolved X-ray diffraction and transmission electron microscopy Note: Solution concentration 0.01 M Note: Occupancies of the Oint sites are undetermined, O is used only as a scatterer
American Mineralogist, 2009, 94, 816-826
9013652 CIFH4.424 Mn O4.212C -15.1349; 2.8465; 7.5135
89.94; 101.561; 89.997
107.593Lopano, C. L.; Heaney, P. J.; Post, J. E.
Cs-exchange in birnessite: Reaction mechanisms inferred from time-resolved X-ray diffraction and transmission electron microscopy Note: Solution concentration 0.05 M Note: Occupancies of the Oint sites are undetermined, O is used only as a scatterer
American Mineralogist, 2009, 94, 816-826
9013852 CIFAl0.721 Fe0.219 H4 Mg2.782 O9 Si1.279C -15.327; 9.233; 14.381
90.2; 97.2; 89.97
701.736Zanazzi, P. F.; Comodi, P.; Nazzareni, S.; Andreozzi, G. B.
Thermal behaviour of chlorite: an in situ single-crystal and powder diffraction study Note: T = 25 C
European Journal of Mineralogy, 2009, 21, 581-589
9013853 CIFAl0.721 Fe0.219 H4 Mg2.782 O9 Si1.279C -15.3454; 9.2584; 14.435
90.29; 97.28; 90
708.618Zanazzi, P. F.; Comodi, P.; Nazzareni, S.; Andreozzi, G. B.
Thermal behaviour of chlorite: an in situ single-crystal and powder diffraction study Note: T = 301 C
European Journal of Mineralogy, 2009, 21, 581-589
9013854 CIFAl0.721 Fe0.219 H4 Mg2.782 O9 Si1.279C -15.3504; 9.2661; 14.447
90.31; 97.29; 90
710.444Zanazzi, P. F.; Comodi, P.; Nazzareni, S.; Andreozzi, G. B.
Thermal behaviour of chlorite: an in situ single-crystal and powder diffraction study Note: T = 399 C
European Journal of Mineralogy, 2009, 21, 581-589
9013855 CIFAl0.721 Fe0.219 H4 Mg2.782 O9 Si1.279C -15.3533; 9.2778; 14.464
90.3; 97.27; 90
712.596Zanazzi, P. F.; Comodi, P.; Nazzareni, S.; Andreozzi, G. B.
Thermal behaviour of chlorite: an in situ single-crystal and powder diffraction study Note: T = 502 C
European Journal of Mineralogy, 2009, 21, 581-589
9013953 CIFAl0.08 Ba5.22 Ca0.58 F6.02 Fe10.08 H7.98 K0.68 Mg0.16 Mn5.12 Na2.58 Nb0.48 O71.98 Si16 Ti7.44 Zr0.16C -110.6965; 13.7861; 21.478
99.345; 92.315; 89.993
3122.56Camara, F.; Sokolova, E.; Nieto, F.
Camaraite, Ba3NaTi4(Fe2+,Mn)8(Si2O7)4O4(OH,F)7. II. The crystal structure and crystal chemistry of a new group-II Ti-disilicate mineral Locality: the Verkhnee Espe alkaline deposit, Akjailyautas Mountains, Kazakhstan
Mineralogical Magazine, 2009, 73, 855-870
2104292 CIF
Paper
B3 Bi O6C 17.4781; 3.934; 6.2321
93.728; 102.933; 90.756
178.24Dinnebier, R. E.; Hinrichsen, B.; Lennie, A.; Jansen, M.
High-pressure crystal structure of the non-linear optical compound BiB~3~O~6~ from two-dimensional powder diffraction data
Acta Crystallographica Section B, 2009, 65, 1-10
1503691 CIFC21 H34 O4C 1 2 117.854; 7.164; 16.135
90; 107.171; 90
1971.8Chen, Jian-Jun; Li, Zheng-Ming; Gao, Kun; Chang, Jin; Yao, Xiao-Jun
Vladimuliecins A and B: cytotoxic pentacyclic pregnanols from Vladimiria muliensis.
Journal of natural products, 2009, 72, 1128-1132
1503695 CIFC31 H50 O4C 1 2 112.3341; 7.3877; 30.799
90; 97.604; 90
2781.7Chen, Wen-Hao; Qi, Huan-Yang; Shi, Yan-Ping
24-Hydroxyoleanane-type triterpenes from the aerial parts and roots of Oxytropis falcata.
Journal of natural products, 2009, 72, 1410-1413
1503778 CIFC41.25 H50 O13.13C 1 2 139.015; 9.2033; 23.6697
90; 101.259; 90
8335.4Boone, Matthew A.; McDonald, Frank E.; Lichter, Joseph; Lutz, Stefan; Cao, Rui; Hardcastle, Kenneth I.
1,5-Alpha-D-mannoseptanosides, ring-size isomers that are impervious to alpha-mannosidase-catalyzed hydrolysis.
Organic letters, 2009, 11, 851-854
1503879 CIFC15 H27 N O2 S2C 1 2 119.68; 6.923; 15.753
90; 125.7; 90
1742.9Checa, Begoña; Gálvez, Erik; Parelló, Ricard; Sau, Miriam; Romea, Pedro; Urpí, Fèlix; Font-Bardia, Mercè; Solans, Xavier
New approach to the stereoselective synthesis of tertiary methyl ethers.
Organic letters, 2009, 11, 2193-2196
1503880 CIFC22 H52 Br2 P4 Pd2C 1 2 118.1731; 10.7733; 17.5878
90; 93.105; 90
3438.4Ogura, Tomokazu; Yoshida, Kazuhiro; Yanagisawa, Akira; Imamoto, Tsuneo
Optically active dinuclear palladium complexes containing a Pd-Pd bond: preparation and enantioinduction ability in asymmetric ring-opening reactions.
Organic letters, 2009, 11, 2245-2248
1503901 CIFC26 H25 Br O4C 1 2 121.672; 6.034; 18.445
90; 111.168; 90
2249.3Nair, Vijay; Babu, Beneesh P.; Vellalath, Sreekumar; Varghese, Vimal; Raveendran, Anabha E.; Suresh, Eringathodi
Nucleophilic heterocyclic carbene catalyzed annulation of enals to chalcones in methanol: a stereoselective synthesis of highly functionalized cyclopentanes.
Organic letters, 2009, 11, 2507-2510
1503961 CIFC24 H50 O5 Si4C 1 2 125.1341; 9.5269; 16.8986
90; 128.434; 90
3169.6Bower, Justin; Box, Matthew R.; Czyzewski, Michal; Goeta, Andres E.; Steel, Patrick G.
Acyl polysilanes: new acyl anion equivalents for additions to electron-deficient alkenes.
Organic letters, 2009, 11, 2744-2747
1504084 CIFC17 H24 N2 O4C 1 2 123.342; 5.7712; 17.317
90; 130.887; 90
1763.6Duguet, Nicolas; Slawin, Alexandra M. Z.; Smith, Andrew D.
An asymmetric hetero-claisen approach to 3-alkyl-3-aryloxindoles.
Organic letters, 2009, 11, 3858-3861
1504096 CIFC23 H34 O4C 1 2 126.323; 6.1374; 13.3377
90; 96.461; 90
2141.1Chin, Yen-Jin; Wang, Shun-Yi; Loh, Teck-Peng
Synthesis of iriomoteolide-1a C13-C23 fragment via asymmetric conjugate addition and Julia-Kocienski coupling reaction.
Organic letters, 2009, 11, 3674-3676
1504185 CIFC16 H18 O4C 1 2 118.1933; 7.711; 12.4502
90; 129.39; 90
1349.87Hanessian, Stephen; Boyer, Nicolas; Reddy, Gone Jayapal; Deschênes-Simard, Benoît
Total synthesis of oidiodendrolides and related norditerpene dilactones from a common precursor: metabolites CJ-14,445, LL-Z1271gamma, oidiolactones A, B, C, and D, and nagilactone F.
Organic letters, 2009, 11, 4640-4643
1504187 CIFC17 H20 O5C 1 2 118.1525; 7.6684; 12.0226
90; 101.178; 90
1641.81Hanessian, Stephen; Boyer, Nicolas; Reddy, Gone Jayapal; Deschênes-Simard, Benoît
Total synthesis of oidiodendrolides and related norditerpene dilactones from a common precursor: metabolites CJ-14,445, LL-Z1271gamma, oidiolactones A, B, C, and D, and nagilactone F.
Organic letters, 2009, 11, 4640-4643
1504215 CIFC27 H40 O7 SiC 1 2 127.8634; 7.012; 18.3625
90; 129.332; 90
2774.98Krawczuk, Paul J.; Schöne, Niklas; Baran, Phil S.
A synthesis of the carbon skeleton of maoecrystal V.
Organic letters, 2009, 11, 4774-4776
1504217 CIFC21 H27 O7C 1 2 130.4299; 7.0493; 19.6268
90; 111.309; 90
3922.31Krawczuk, Paul J.; Schöne, Niklas; Baran, Phil S.
A synthesis of the carbon skeleton of maoecrystal V.
Organic letters, 2009, 11, 4774-4776
1504264 CIFC21 H20 Br N O4C 1 2 117.9311; 10.112; 22.4591
90; 101.184; 90
3994.9Hong, Bor-Cherng; Jan, Rei-Hau; Tsai, Chih-Wei; Nimje, Roshan Y.; Liao, Ju-Hsiou; Lee, Gene-Hsiang
Organocatalytic enantioselective cascade Michael-Michael-Wittig reactions of phosphorus ylides: one-pot synthesis of the all-cis trisubstituted cyclohexenecarboxylates via the [1 + 2 + 3] annulation.
Organic letters, 2009, 11, 5246-5249
1515948 CIFC28 H26 N2 O4 TiC 1 2 125.394; 7.3361; 6.313
90; 98.11; 90
1164.31Claffey, James; Deally, Anthony; Gleeson, Brendan; Hogan, Megan; Méndez, Luis Miguel Menéndez; Müller-Bunz, Helge; Patil, Siddappa; Wallis, Denise; Tacke, Matthias
Pseudo-halide derivatives of titanocene: synthesis and cytotoxicity studies.
Metallomics : integrated biometal science, 2009, 1, 511-517
1520346 CIFC21 H26 O9 SC 1 2 118.9488; 5.6024; 20.7934
90; 90.355; 90
2207.36Croft, Anna K.; Tizzard, Graham J.; Hursthouse, Michael B.
Acetic acid 4,5-diacetoxy-6-acetoxymethyl-2-benzylsulfanyl- tetrahydro-pyran-3-yl ester
Crystal Structure Report Archive, 2009, 858
1528508 CIFBi10 Mo3 O24C 1 2 123.7282; 5.64906; 8.68173
90; 95.8668; 90
1157.62Galy, J.; Hernandez-Velasco, J.; Landa-Canovas, A.R.; Castro, A.; Vila, E.
Ab initio structure determination and Rietveld refinement of Bi10 Mo3 O24 the member n=3 of the Bi(2n+4) Mo(n) O6(n+1) series
Journal of Solid State Chemistry, 2009, 182, 1177-1187
1551798 CIFC19 H23 N2 O6.5C 1 2 132.997; 5.8823; 9.8717
90; 103.483; 90
1863.3FUJII, Isao
Crystal Structure of L-(S)-Tryptophane D-(R)-mandelate 1.5H2O
X-ray Structure Analysis Online, 2009, 25, 35
2017014 CIF
HKL
Paper
C24 H30 N2 O3C 1 2 124.5935; 7.0351; 24.9875
90; 105.116; 90
4173.69Ramos Silva, Manuela; Moreira, Vânia M.; Cardoso, Cláudia; Matos Beja, Ana; Salvador, Jorge A. R.
3-Oxoandrosta-4,6-dien-17β-yl 2-methyl-1<i>H</i>-imidazole-1-carboxylate and 3-oxo-5α-androst-17β-yl 2-methyl-1<i>H</i>-imidazole-1-carboxylate: C—H···π and π‒π intermolecular interactions
Acta Crystallographica Section C, 2009, 65, o88-o91
2104291 CIF
Paper
B3 Bi O6C 1 2 17.3786; 4.3992; 6.3388
90; 104.374; 90
199.32Dinnebier, R. E.; Hinrichsen, B.; Lennie, A.; Jansen, M.
High-pressure crystal structure of the non-linear optical compound BiB~3~O~6~ from two-dimensional powder diffraction data
Acta Crystallographica Section B, 2009, 65, 1-10
2104298 CIF
HKL
Paper
C41 H26 N2 O8C 1 2 116.9672; 8.0833; 25.0204
90; 116.312; 90
3076Rychlewska, 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
2104301 CIF
HKL
Paper
C46 H40 N4 O8 SC 1 2 122.374; 9.319; 20.515
90; 110.14; 90
4015.9Rychlewska, 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
2104405 CIF
Paper
Bi10 Mo3 O24C 1 2 123.7282; 5.6491; 8.6817
90; 95.87; 90
1157.62Landa-Cánovas, Ángel R.; Vila, Eladio; Hernández-Velasco, Jorge; Galy, Jean; Castro, Alicia
Structural elucidation of the Bi~2(<i>n~+2)</i>Mo~<i>n~</i>O~6(<i>n~+1)</i> (<i>n</i> = 3, 4, 5 and 6) family of fluorite superstructures by transmission electron microscopy
Acta Crystallographica Section B, 2009, 65, 458-466
2104407 CIF
Paper
Bi14 Mo5 O36C 1 2 134.476; 5.6414; 8.6433
90; 99.69; 90
1657.08Landa-Cánovas, Ángel R.; Vila, Eladio; Hernández-Velasco, Jorge; Galy, Jean; Castro, Alicia
Structural elucidation of the Bi~2(<i>n~+2)</i>Mo~<i>n~</i>O~6(<i>n~+1)</i> (<i>n</i> = 3, 4, 5 and 6) family of fluorite superstructures by transmission electron microscopy
Acta Crystallographica Section B, 2009, 65, 458-466
2104586 CIF
Paper
C14 H21 N O7C 1 2 18.913; 5.0967; 31.892
90; 95.313; 90
1442.5Marsh, Richard E.
Space groups <i>P</i>1 and <i>Cc</i>: how are they doing?
Acta Crystallographica Section B, 2009, 65, 782-783
2220551 CIF
HKL
Paper
C60 H72 Br8 Mn4 N16 O4C 1 2 128.559; 9.2318; 13.899
90; 99.111; 90
3618.3Hwang, In-Chul; Ha, Kwang
Diaqua[<i>N</i>,<i>N</i>'-bis(2-pyridylmethylene)propane-1,3-diamine]manganese(II) dibromide‒aquabromido[<i>N</i>,<i>N</i>'-bis(2-pyridylmethylene)propane-1,3-diamine]manganese(II) bromide‒dibromido[<i>N</i>,<i>N</i>'-bis(2-pyridylmethylene)propane-1,3-diamine]manganese(II) (1/2/1)
Acta Crystallographica Section E, 2009, 65, m64-m65
2220918 CIF
HKL
Paper
C16 H26 N4 O10 S2C 1 2 122.286; 7.2005; 15.8772
90; 110.119; 90
2392.4Sun, Weidong; Yao, Jin; Bai, Lifei; Wang, Xiaoming
1-(2,3,4,6-Tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranosyl)-3-thioureidothiourea monohydrate
Acta Crystallographica Section E, 2009, 65, o242
2220951 CIF
HKL
Paper
C27 H40 O4C 1 2 112.66; 6.443; 30.167
90; 98.02; 90
2436.6Zi, Tie-Ying; Zang, Zhi-He; Yuan, Ming-Yong; Zheng, Ling-Li
(25<i>R</i>)-5a-Spirostane-3,12-dione
Acta Crystallographica Section E, 2009, 65, o232
2221061 CIF
HKL
Paper
C32 H66 Br0.17 Cl1.83 N2 O8C 1 2 121.2037; 5.2166; 17.2517
90; 97.037; 90
1893.86Zmejkovski, Bojana B.; Kaluderović, Goran N.; Gómez-Ruiz, Santiago; Sabo, Tibor J.
(<i>S</i>,<i>S</i>)-<i>N</i>,<i>N</i>'-Bis(1-carboxy-2-methylpropyl)ethylenediammonium dihalide cyclopentanol tetrasolvate (halide = bromide/chloride ≃1:12)
Acta Crystallographica Section E, 2009, 65, o656-o657
2221687 CIF
HKL
Paper
C25 H27 N O2C 1 2 133.131; 5.9916; 21.472
90; 97.715; 90
4223.8Jin, Jia; Xue, Si-Jia; Li, Xue-Fei; Fang, Zhi-Kun
(+)-[1-(4-Methoxybenzyl)pyrrolidin-2-yl]diphenylmethanol
Acta Crystallographica Section E, 2009, 65, o1035
2221766 CIF
HKL
Paper
C31.5 H50 O3.25C 1 2 128.5864; 12.2408; 19.3545
90; 120.552; 90
5832.3Awang, Khalijah; Yusoff, Mahfizah; Mohamad, Khalit; Chong, Soo Lim; Ng, Seik Weng
3-Oxoolean-1-en-28-oic acid‒<i>n</i>-hexane‒water (4/1/1) from the bark of <i>Walsura pinnata</i> Hassk
Acta Crystallographica Section E, 2009, 65, o1166
2221889 CIF
HKL
Paper
C29 H30 N2 O4C 1 2 114.0683; 4.5659; 19.048
90; 97.321; 90
1213.6Sun, Yin-Xia; Wu, Jian-Chao; Dong, Wen-Kui; Gong, Shang-sheng; Tong, Jun-Feng
2,2'-{1,1'-[Pentane-1,5-diylbis(oxynitrilo)]diethylidyne}di-1-naphthol
Acta Crystallographica Section E, 2009, 65, o1238
2222166 CIF
HKL
Paper
C7 H10 Cl N Na O3.5 SC 1 2 111.011; 6.6434; 14.447
90; 100.35; 90
1039.61Gowda, B. Thimme; Foro, Sabine; Fuess, Hartmut
Sodium <i>N</i>-chloro-2-methylbenzenesulfonamidate sesquihydrate
Acta Crystallographica Section E, 2009, 65, m700
2222191 CIF
HKL
Paper
C18 H30 Ni3 O24C 1 2 117.3394; 12.8724; 6.5462
90; 111.609; 90
1358.42Hsu, Shih-Chen; Chiang, Pei-Hsuan; Chang, Chih-Hsien; Lin, Chia-Her
<i>catena</i>-Poly[[tetraaquanickel(II)]-μ~3~-benzene-1,3,5-tricarboxylato-3':1:2-κ^4^<i>O</i>^1^:<i>O</i>^3^,<i>O</i>^3'^:<i>O</i>^5^-[tetraaquanickel(II)]-μ~2~-benzene-1,3,5-tricarboxylato-2:3κ^2^<i>O</i>^1^:<i>O</i>^3^-[tetraaquanickel(II)]]
Acta Crystallographica Section E, 2009, 65, m625-m626
2222488 CIF
HKL
Paper
C24 H41 N O3C 1 2 19.934; 7.469; 30.647
90; 91.547; 90
2273Li, Jiang-Sheng; Simpson, Jim; Li, Xiao-Jun; Li, Xun; Huang, Peng-Mian
<i>N</i>-<i>tert</i>-Butyl-3-hydroxy-5-androstene-17-carboxamide monohydrate
Acta Crystallographica Section E, 2009, 65, o1507-o1508
2222648 CIF
HKL
Paper
C8 H18 Cl3 Fe N2 O6C 1 2 19.872; 9.6636; 8.4268
90; 109.57; 90
757.5Cai, Ying
1,4-Diazoniabicyclo[2.2.2]octane diaquadichlorido(oxalato-κ^2^<i>O</i>,<i>O</i>')iron(III) chloride
Acta Crystallographica Section E, 2009, 65, m877
2222848 CIF
HKL
Paper
C16.5 H28 N6 O3.5C 1 2 119.857; 7.2552; 13.735
90; 98.27; 90
1958.2Pham, Phuong-Truc T.
Abacavir methanol 2.5-solvate
Acta Crystallographica Section E, 2009, 65, o1937
2222914 CIF
HKL
Paper
C18 H28 N2 O11 S2C 1 2 113.7204; 11.5853; 7.6579
90; 116.413; 90
1090.19Arbuckle, William; Kennedy, Alan R.; Morrison, Catriona A.
(<i>R</i>,<i>R</i>)-Disynephrine ether bis(hydrogen sulfate)
Acta Crystallographica Section E, 2009, 65, o1768-o1769
2222938 CIF
HKL
Paper
C26 H20 Ag N5 O3C 1 2 113.911; 7.34; 12.669
90; 113.43; 90
1186.9Wang, Zhao-Yang; Zhang, Pei-Pei; Yang, Guang; Ng, Seik Weng
Bis[5-(2-naphthyl)-1<i>H</i>-pyrazole-κ<i>N</i>^2^]silver(I) nitrate
Acta Crystallographica Section E, 2009, 65, m980
2222957 CIF
HKL
Paper
C14 H10 Cl3 N O4C 1 2 112.8171; 7.5954; 16.0909
90; 109.815; 90
1473.72Smith, Graham; Wermuth, Urs D.; White, Jonathan M.
4-Chloroanilinium 2-carboxy-4,5-dichlorobenzoate
Acta Crystallographica Section E, 2009, 65, o2111
2223028 CIF
HKL
Paper
C10 H13 N5 O SC 1 2 111.5142; 5.8804; 16.6891
90; 95.292; 90
1125.17Fun, Hoong-Kun; Yeap, Chin Sing; Malladi, Shridhar; Padaki, Mahesh; Isloor, Arun M.
4-Amino-3-[(4-methoxyphenyl)aminomethyl]-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione
Acta Crystallographica Section E, 2009, 65, o2213
2223054 CIF
HKL
Paper
C17 H16 N4 O6C 1 2 129.005; 4.7878; 6.3579
90; 99.144; 90
871.7Dong, Wen-Kui; Sun, Yin-Xia; Tong, Jun-Feng; Zhao, Hai-Hong; Wang, Li
1,3-Bis[(4-nitrobenzylidene)aminooxy]propane
Acta Crystallographica Section E, 2009, 65, o2141-o2142
2223343 CIF
HKL
Paper
C25 H31 N O3C 1 2 134.736; 17.729; 11.013
90; 97.62; 90
6722Wang, Bo; Ye, Nengsheng; Li, Zhiyuan; Zhong, Jiangchun; Hou, Shicong
(1<i>R</i>,3<i>S</i>)-Methyl 3-[(<i>S</i>)-2-(hydroxydiphenylmethyl)pyrrolidin-1-ylmethyl]-2,2-dimethylcyclopropanecarboxylate
Acta Crystallographica Section E, 2009, 65, o2474
2223683 CIF
HKL
Paper
C21 H36 N2 O7C 1 2 121.995; 9.9534; 10.531
90; 100.631; 90
2265.9Jing, Lin-Hai
Bis{[1-(<i>tert</i>-butoxycarbonyl)pyrrolidin-2-yl]methyl} carbonate
Acta Crystallographica Section E, 2009, 65, o2610
2223684 CIF
HKL
Paper
C10 H16 O3C 1 2 126.796; 6.656; 12.25
90; 112.23; 90
2022.4Gao, Yan-Qing; Shang, Shi-Bin; Xu, Xu; Rao, Xiao-Ping; Wang, Hong-Xiao
2-Hydroxy-6,6-dimethylbicyclo[3.1.1]heptane-2-carboxylic acid
Acta Crystallographica Section E, 2009, 65, o2748
2224129 CIF
HKL
Paper
C10 H10 N4 O3C 1 2 113.944; 6.2551; 11.882
90; 93.857; 90
1034Tanak, Hasan; Köysal, Yavuz; Yavuz, Metin; Işık, Şamil; Gül, Gülşah
4-(2,3-Dihydroxybenzylideneamino)-3-methyl-1<i>H</i>-1,2,4-triazol-5(4<i>H</i>)-one
Acta Crystallographica Section E, 2009, 65, o3039
2224253 CIF
HKL
Paper
C33 H37 N11 O5 S3C 1 2 144.409; 7.1777; 11.2683
90; 90.587; 90
3591.6Asghar, Amina; Iqbal, Mohammad S.; Tahir, M. Nawaz
Mutual prodrug of cephazolin and benzydamin: 3-[(1-benzyl-1<i>H</i>-indazol-3-yl)oxy]-<i>N</i>,<i>N</i>-dimethylpropan-1-aminium 3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-8-oxo-7-[(1<i>H</i>-tetrazol-1-yl)acetamido]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate (benzydaminium cephazolinate)
Acta Crystallographica Section E, 2009, 65, o3132-o3133
4001043 CIFC14 O5 VC 1 2 120.652; 6.798; 9.954
90; 92.145; 90
1396.5Djerdj, Igor; Cao, Minhua; Rocquefelte, Xavier; Černý, Radovan; Jagličić, Zvonko; Arčon, Denis; Potočnik, Anton; Gozzo, Fabia; Niederberger, Markus
Structural Characterization of a Nanocrystalline Inorganic−Organic Hybrid with Fiberlike Morphology and One-Dimensional Antiferromagnetic Properties
Chemistry of Materials, 2009, 21, 3356
4001075 CIFC51 H30 Cu3 N3 O12C 1 2 117.25; 19.467; 14.031
90; 95.22; 90
4692Kanoo, Prakash; Matsuda, Ryotaro; Higuchi, Masakazu; Kitagawa, Susumu; Maji, Tapas Kumar
New Interpenetrated Copper Coordination Polymer Frameworks having Porous Properties
Chemistry of Materials, 2009, 21, 5860
4024238 CIFC24 H12 D4C 1 2 115.423; 13.0638; 16.267
90; 100.976; 90
3217.6Hui Huang; Timothy Stewart; Matthias Gutmann; Takashi Ohhara; Nobuo Niimura; Yu-Xue Li; Jian-Feng Wen; Robert Bau; Henry N. C. Wong
To Flip or Not To Flip? Assessing the Inversion Barrier of the Tetraphenylene Framework with Enantiopure 2,15-Dideuteriotetraphenylene and 2,7-Dimethyltetraphenylene
Journal of Organic Chemistry, 2009, 74, 359-369
4024383 CIFC15 H18 Br3 Cl O3C 1 2 117.6506; 5.65986; 19.6269
90; 112.271; 90
1814.46D. Christopher Braddock; David S. Millan; Yolanda Pérez-Fuertes; Rebecca H. Pouwer; Richard N. Sheppard; Savade Solanki; Andrew J. P. White
Bromonium Ion Induced Transannular Oxonium Ion Formation-Fragmentation in Model Obtusallene Systems and Structural Reassignment of Obtusallenes V-VII
Journal of Organic Chemistry, 2009, 74, 1835-1841
4024443 CIFC12 H17 N O5 SC 1 2 112.651; 5.5009; 19.408
90; 92.321; 90
1349.6Appu Aravind; Muthukumar Gomathi Sankar; Babu Varghese; Sundarababu Baskaran
Regioselective Reductive Cleavage of Bis-benzylidene Acetal: Stereoselective Synthesis of Anticancer Agent OGT2378 and Glycosidase Inhibitor 1,4-Dideoxy-1,4-imino-l-xylitol
Journal of Organic Chemistry, 2009, 74, 2858-2861
4024473 CIFC20 H23 N O2 SC 1 2 127.856; 6.5846; 10.3007
90; 104.099; 90
1832.4Michael Harmata; Kanok-on Rayanil; Vinson R. Espejo; Charles L. Barnes
Benzothiazines in Synthesis. Further Studies of the Intramolecular, Stereoselective Addition of Sulfonimidoyl Carbanions to α,β-Unsaturated Functional Groups
Journal of Organic Chemistry, 2009, 74, 3214-3216
4024526 CIFC22 H31 Br N2 O6C 1 2 119.0217; 6.1365; 20.6038
90; 106.897; 90
2301.19Andreas A. Grauer; Chiara Cabrele; Manfred Zabel; Burkhard König
Stable Right- and Left-Handed Peptide Helices containing Cα-Tetrasubstituted α-Amino Acids
Journal of Organic Chemistry, 2009, 74, 3718-3726
4024530 CIFC22 H31 Br N2 O6C 1 2 119.0053; 6.12864; 20.606
90; 106.886; 90
2296.64Andreas A. Grauer; Chiara Cabrele; Manfred Zabel; Burkhard König
Stable Right- and Left-Handed Peptide Helices containing Cα-Tetrasubstituted α-Amino Acids
Journal of Organic Chemistry, 2009, 74, 3718-3726
4024534 CIFC28 H44 N4 O2 S2C 1 2 112.5603; 18.4561; 12.4825
90; 90; 90
2893.6Seb Caille; Sheng Cui; Tsang-Lin Hwang; Xiang Wang; Margaret M. Faul
Two Asymmetric Syntheses of AMG 221, an Inhibitor of 11β-Hydroxysteroid Dehydrogenase Type 1
Journal of Organic Chemistry, 2009, 74, 3833-3842
4024567 CIFC17 H24 N2 O6C 1 2 123.982; 6.0546; 12.621
90; 92.222; 90
1831.1N. Deppermann; A. H. G. P. Prenzel; A. Beitat; W. Maison
Synthesis of Proline-Based Diketopiperazine Scaffolds
Journal of Organic Chemistry, 2009, 74, 4267-4271
4024730 CIFC10 H18 O2C 1 2 118.7017; 5.9044; 9.0335
90; 95.768; 90
992.45Olivier Corminboeuf; Larry E. Overman; Lewis D. Pennington
A Unified Strategy for Enantioselective Total Synthesis of Cladiellin and Briarellin Diterpenes: Total Synthesis of Briarellins E and F and the Putative Structure of Alcyonin and Revision of Its Structure Assignment
Journal of Organic Chemistry, 2009, 74, 5458-5470

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