Crystallography Open Database

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Searching journal of publication like 'Acta crystallographica Section B, Structural science, crystal engineering and materials'

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2102495 CIF
Paper
C42 H46 N2 O2 Si2P 1 21/c 114.6528; 8.1361; 16.7852
90; 117.868; 90
1769Turkington, David E.; Lough, Alan J.; Ferguson, George; Glidewell, Christopher
Hydrogen-bonded adducts of triphenylsilanol with diamines: a finite ten-molecule aggregate, and chain, sheet and framework structures built from O—H···O, O—H···N and C—H···π(arene) hydrogen bonds
Acta Crystallographica Section B, 2004, 60, 238-248
2102496 CIF
Paper
C48 H46 N2 O3 Si2P -18.7793; 14.3503; 16.8948
76.612; 88.287; 83.816
2058.58Turkington, David E.; Lough, Alan J.; Ferguson, George; Glidewell, Christopher
Hydrogen-bonded adducts of triphenylsilanol with diamines: a finite ten-molecule aggregate, and chain, sheet and framework structures built from O—H···O, O—H···N and C—H···π(arene) hydrogen bonds
Acta Crystallographica Section B, 2004, 60, 238-248
2102497 CIF
Paper
C46 H44 N2 O4 Si2P -18.9058; 13.9098; 16.9083
75.053; 88.509; 86.951
2020.67Turkington, David E.; Lough, Alan J.; Ferguson, George; Glidewell, Christopher
Hydrogen-bonded adducts of triphenylsilanol with diamines: a finite ten-molecule aggregate, and chain, sheet and framework structures built from O—H···O, O—H···N and C—H···π(arene) hydrogen bonds
Acta Crystallographica Section B, 2004, 60, 238-248
2102498 CIF
Paper
Ir MgC m c e18.46948; 16.1745; 16.82131
90; 90; 90
5025.11Cerný, Radovan; Renaudin, Guillaume; Favre-Nicolin, Vincent; Hlukhyy, Viktor; Pöttgen, Rainer
Mg~1+<i>x~</i>Ir~1{-~<i>x</i>} (<i>x</i> = 0, 0.037 and 0.054), a binary intermetallic compound with a new orthorhombic structure type determined from powder and single-crystal X-ray diffraction
Acta Crystallographica Section B, 2004, 60, 272-281
2102499 CIF
Paper
Cu2 SeF 2 35.8164; 5.8164; 5.8164
90; 90; 90
196.772Machado, K. D.; de Lima, J. C.; Grandi, T. A.; Campos, C. E. M.; Maurmann, C. E.; Gasperini, A. A. M.; Souza, S. M.; Pimenta, A. F.
Structural study of Cu~2{-~<i>x</i>}Se alloys produced by mechanical alloying
Acta Crystallographica Section B, 2004, 60, 282-286
2102500 CIF
Paper
Cu1.8 SeF m -3 m5.7762; 5.7762; 5.7762
90; 90; 90
192.72Machado, K. D.; de Lima, J. C.; Grandi, T. A.; Campos, C. E. M.; Maurmann, C. E.; Gasperini, A. A. M.; Souza, S. M.; Pimenta, A. F.
Structural study of Cu~2{-~<i>x</i>}Se alloys produced by mechanical alloying
Acta Crystallographica Section B, 2004, 60, 282-286
2102501 CIF
Paper
C10 H8 Br N3 O2P 1 21/m 17.0281; 6.9388; 11.5612
90; 106.735; 90
539.92Kubicki, Maciej
Structural phase transitions, and Br···N and Br···Br interactions in 1-phenyl-2-methyl-4-nitro-5-bromoimidazole
Acta Crystallographica Section B, 2004, 60, 333-342
2102502 CIF
Paper
C10 H8 Br N3 O2P 1 21/m 17.018; 6.916; 11.546
90; 106.41; 90
537.57Kubicki, Maciej
Structural phase transitions, and Br···N and Br···Br interactions in 1-phenyl-2-methyl-4-nitro-5-bromoimidazole
Acta Crystallographica Section B, 2004, 60, 333-342
2102503 CIF
Paper
C10 H8 Br N3 O2P 1 21/c 16.9955; 6.8657; 22.99
90; 106.356; 90
1059.5Kubicki, Maciej
Structural phase transitions, and Br···N and Br···Br interactions in 1-phenyl-2-methyl-4-nitro-5-bromoimidazole
Acta Crystallographica Section B, 2004, 60, 333-342
2102504 CIF
Paper
C10 H8 Br N3 O2P 1 21/c 16.9854; 6.8362; 22.945
90; 106.466; 90
1050.8Kubicki, Maciej
Structural phase transitions, and Br···N and Br···Br interactions in 1-phenyl-2-methyl-4-nitro-5-bromoimidazole
Acta Crystallographica Section B, 2004, 60, 333-342
2102505 CIF
Paper
C10 H8 Br N3 O2P 1 21/c 16.9723; 6.8169; 22.9
90; 106.478; 90
1043.72Kubicki, Maciej
Structural phase transitions, and Br···N and Br···Br interactions in 1-phenyl-2-methyl-4-nitro-5-bromoimidazole
Acta Crystallographica Section B, 2004, 60, 333-342
2102506 CIF
Paper
C10 H8 Br N3 O2P -16.9654; 6.8215; 11.3983
92.683; 106.506; 90.277
518.6Kubicki, Maciej
Structural phase transitions, and Br···N and Br···Br interactions in 1-phenyl-2-methyl-4-nitro-5-bromoimidazole
Acta Crystallographica Section B, 2004, 60, 333-342
2102507 CIF
Paper
C10 H8 Br N3 O2P 1 21/c 16.9923; 6.8497; 22.9702
90; 106.419; 90
1055.3Kubicki, Maciej
Structural phase transitions, and Br···N and Br···Br interactions in 1-phenyl-2-methyl-4-nitro-5-bromoimidazole
Acta Crystallographica Section B, 2004, 60, 333-342
2102508 CIF
Paper
Cl2 H14 N4 O10 Pt2P 21 21 217.3422; 12.9876; 13.9429
90; 90; 90
1329.56Sakai, Ken; Konno, Yosuke; Takayama, Noboru; Takahashi, Satoru
First bent form for the hydroxo-bridged <i>cis</i>-diammineplatinum(II) dimer [Pt~2~(NH~3~)~4~(μ-OH)~2~](ClO~4~)~2~
Acta Crystallographica Section B, 2004, 60, 255-262
2102509 CIF
Paper
C10 H12 Cu N2 O6 SI 1 2/a 16.963; 12.4686; 14.854
90; 101.01; 90
1265.9Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102510 CIF
Paper
C8 H22 Cl Co N6 O5C m c 219.515; 11.909; 13.003
90; 90; 90
1473.4Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102511 CIF
Paper
C23 H39 N5 O4 Si2C 2 2 2113.1422; 12.1676; 34.638
90; 90; 90
5538.9Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102512 CIF
Paper
C20 H30 O2I 1 2/a 127.869; 5.771; 11.758
90; 91.43; 90
1890.5Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102513 CIF
Paper
C23 H34 Cl2 Cu N4 OI 1 2/a 118.63; 16.61; 16.972
90; 108.02; 90
4994.3Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102514 CIF
Paper
C32 H38 Ca N4 O12 S2C 2 2 2119.036; 6.508; 29.178
90; 90; 90
3615Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102515 CIF
Paper
C21 H18 M N10 O2C m c 2115.151; 22.13; 6.874
90; 90; 90
2305Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102516 CIF
Paper
C13 H12 Cl N O4C m c a6.707; 17.023; 22.938
90; 90; 90
2618.9Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102517 CIF
Paper
C10 H33 N4 O18.5 PC 2 2 2123.1914; 8.65; 21.9
90; 90; 90
4393.3Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102518 CIF
Paper
C18 H22 N2 O8 Zn2P 1 21/n 18.626; 28.871; 8.868
90; 99.02; 90
2181.2Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102519 CIF
Paper
C14 H24 Fe N2 O8I 1 2/m 111.78; 9.734; 8.401
90; 104.05; 90
934.5Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102520 CIF
Paper
C10 H24 F6 N4 O2 P ReI 1 2/a 117.257; 5.533; 18.053
90; 98.14; 90
1706.4Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102521 CIF
Paper
C60 H120 Fe6 N12 O24C c c a :220.939; 25.243; 16.048
90; 90; 90
8482.4Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102522 CIF
Paper
C120 H104 P4 PdC 2 2 2129.327; 16.743; 19.458
90; 90; 90
9554Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102523 CIF
Paper
C19 H22 Cl2 Cu N6 O5 S4I 1 2/a 130.123; 7.564; 11.044
90; 91.27; 90
2516Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102524 CIF
Paper
C14 H18 Cd N2 O7C 1 2/c 115.2963; 6.2028; 17.815
90; 106.196; 90
1623.2Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102525 CIF
Paper
C20 H15 Fe N O2P 1 21/n 110.391; 7.252; 20.662
90; 97.47; 90
1543.8Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102526 CIF
Paper
C20 H44 Cl6 Mg3 O14P m n a13.303; 7.835; 18.169
90; 90; 90
1893.7Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102527 CIF
Paper
C12 N6 O12 Re3P n m a20.639; 16.657; 6.705
90; 90; 90
2305.1Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102528 CIF
Paper
C10 H7 N3 S2P 1 21/m 15.628; 7.207; 13.126
90; 100.12; 90
524.1Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102529 CIF
Paper
C2 Cl4 O2 Pt2P 42/m11.183; 11.183; 3.525
90; 90; 90
440.8Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102530 CIF
Paper
C7 H9 N O2P 1 21/m 17.11; 6.993; 7.678
90; 117.04; 90
340Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102531 CIF
Paper
C38 H33 Cl2 N2 P2 Re S2C 1 2/c 117.514; 10.639; 20.106
90; 102.29; 90
3660.5Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102532 CIF
Paper
C12 H19 Cr O4C m c a16.409; 10.506; 7.825
90; 90; 90
1349Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102533 CIF
Paper
C12 H23 Cl3 N P2 ReC m c m11.0341; 16.814; 10.844
90; 90; 90
2011.9Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102534 CIF
Paper
C12 H13 Ir3C m c m11.2624; 9.711; 25.998
90; 90; 90
2843.38Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102535 CIF
Paper
C48 H36 Cl6P 1 21/n 115.592; 8.642; 16.677
90; 114.773; 90
2040.4Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102536 CIF
Paper
C18 H18 N6 O4 Tc2P n n a13.869; 10.851; 12.799
90; 90; 90
1926.2Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102537 CIF
Paper
C6 H18 Cl2 N2 PdC 1 2/m 18.929; 8.437; 7.542
90; 92.65; 90
567.6Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2102538 CIF
Paper
C15 H21 F9 O2P -111.253; 13.75; 29.289
78.01; 89.72; 81.16
4378.6Lehmler, Hans-Joachim; Parkin, Sean; Brock, Carolyn Pratt
Packing conflicts in the <i>Z</i>' = 5 structure of CF~3~(CF~2~)~3~(CH~2~)~10~COOH
Acta Crystallographica Section B, 2004, 60, 325-332
2102539 CIF
HKL
Paper
C17 H12 N4 O4P n a 2114.0059; 5.1399; 41.9853
90; 90; 90
3022.48Ohashi, Yuji
Packing-dependent photochromism: the case of photoinduced intramolecular proton transfer in 6-(2',4'-dinitrobenzyl)-2,2'-bipyridine
Acta Crystallographica Section B, 2004, 60, 343-349
2102540 CIF
HKL
Paper
C17 H12 N4 O4P 1 21/c 120.836; 5.2746; 14.0971
90; 104.457; 90
1500.24Ohashi, Yuji
Packing-dependent photochromism: the case of photoinduced intramolecular proton transfer in 6-(2',4'-dinitrobenzyl)-2,2'-bipyridine
Acta Crystallographica Section B, 2004, 60, 343-349
2102541 CIF
HKL
Paper
C11 H12 O3P -18.7336; 10.959; 17.2709
91.232; 92.703; 109.472
1555.53Fernandes, Manuel A.; Levendis, Demetrius C.; Schoening, F. R. Ludwig
A new polymorph of <i>ortho</i>-ethoxy-<i>trans</i>-cinnamic acid: single-to-single-crystal phase transformation and mechanism
Acta Crystallographica Section B, 2004, 60, 300-314
2102542 CIF
HKL
Paper
C11 H12 O3P -18.7373; 11.0167; 17.295
91.187; 92.775; 108.938
1571.62Fernandes, Manuel A.; Levendis, Demetrius C.; Schoening, F. R. Ludwig
A new polymorph of <i>ortho</i>-ethoxy-<i>trans</i>-cinnamic acid: single-to-single-crystal phase transformation and mechanism
Acta Crystallographica Section B, 2004, 60, 300-314
2102543 CIF
HKL
Paper
C11 H12 O3P -18.6759; 11.0003; 17.299
92.552; 92.347; 111.155
1535.3Fernandes, Manuel A.; Levendis, Demetrius C.; Schoening, F. R. Ludwig
A new polymorph of <i>ortho</i>-ethoxy-<i>trans</i>-cinnamic acid: single-to-single-crystal phase transformation and mechanism
Acta Crystallographica Section B, 2004, 60, 300-314
2102544 CIF
HKL
Paper
C11 H12 O3P -18.6452; 10.8577; 17.262
92.47; 92.102; 112.563
1492.4Fernandes, Manuel A.; Levendis, Demetrius C.; Schoening, F. R. Ludwig
A new polymorph of <i>ortho</i>-ethoxy-<i>trans</i>-cinnamic acid: single-to-single-crystal phase transformation and mechanism
Acta Crystallographica Section B, 2004, 60, 300-314

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