Crystallography Open Database

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Searching journal of publication like 'Acta Crystallographica Section B' volume of publication is 58

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2103095 CIF
Paper
C8 H8 Cu N10 O4P 1 21/c 17.1248; 13.6; 6.7973
90; 97.821; 90
652.49Kožíšek, Jozef; Hansen, Niels, K.; Fuess, Hartmut
Nucleophilic addition reaction in coordinated non-linear pseudohalides : Experimental Charge Density Analysis in trans-bis(cyanamidonitrato-N:O) bis(imidazole-N^3^) copper(II) complex.
Acta Crystallographica, Section B, 2002, 58, 463-470
2103096 CIF
Paper
Cl2 H8 Mg O4P 1 21/c 15.9001; 7.2709; 8.4199
90; 111.007; 90
337.2Kaduk, James A.
Use of the Inorganic Crystal Structure Database as a problem solving tool
Acta Crystallographica, Section B: Structural Science, 2002, 58, 370-379
2103097 CIF
Paper
C2 H14 Fe2 N2 O11C m c m6.6154; 12.0639; 6.0263
90; 90; 90
480.944Kaduk, James A.
Use of the Inorganic Crystal Structure Database as a problem solving tool
Acta Crystallographica, Section B: Structural Science, 2002, 58, 370-379
2103098 CIF
Paper
Cl2 H4 Mg O2C 1 2/m 17.389; 8.55; 3.6488
90; 98.96; 90
227.69Kaduk, James A.
Use of the Inorganic Crystal Structure Database as a problem solving tool
Acta Crystallographica, Section B: Structural Science, 2002, 58, 370-379
2103099 CIF
Paper
Cl2 H2 Mg OP n m a8.899; 3.634; 11.398
90; 90; 90
368.6Kaduk, James A.
Use of the Inorganic Crystal Structure Database as a problem solving tool
Acta Crystallographica, Section B: Structural Science, 2002, 58, 370-379
2103100 CIF
Paper
Al4 H50 O52 S7P -112.5882; 13.0724; 7.3353
108.162; 70.536; 112.658
1026.68Kaduk, James A.
Use of the Inorganic Crystal Structure Database as a problem solving tool
Acta Crystallographica, Section B: Structural Science, 2002, 58, 370-379
2103101 CIF
Paper
Fe H2 O5 SC 1 2/c 17.1157; 7.518; 7.5988
90; 116.307; 90
364.4Kaduk, James A.
Use of the Inorganic Crystal Structure Database as a problem solving tool
Acta Crystallographica, Section B: Structural Science, 2002, 58, 370-379
2103102 CIF
Paper
Al2 H34 O29 S3P -17.42; 26.97; 6.062
89.57; 97.34; 91.53
1202.7Kaduk, James A.
Use of the Inorganic Crystal Structure Database as a problem solving tool
Acta Crystallographica, Section B: Structural Science, 2002, 58, 370-379
2103104 CIF
Paper
C24 H20 Hg K N4 S20P -16.648; 14.888; 20.38
86.2; 86.02; 81
1984.3Kazheva, Olga; Canadell, Enric; Aleksandrov, Grigorii; Kushch, Nataliya; Dyachenko, Oleg
Crystal and electronic structure of a new metallic modification of (ET)~2~[KHg(NCS)~4~]
Acta Crystallographica, Section B, 2002, 58, 471-476
2103105 CIF
Paper
C20 H18 Cl4 N2C 1 2/c 115.824; 9.1501; 13.894
90; 102.879; 90
1961.1Britton, Doyle
Planar packing of tetrachlorodicyanobenzene isomers
Acta Crystallographica, Section B: Structural Science, 2002, 58, 553-563
2103106 CIF
Paper
C20 H18 Cl4 N2P -17.529; 8.9503; 9.0513
118.425; 109.414; 95.139
482.8Britton, Doyle
Planar packing of tetrachlorodicyanobenzene isomers
Acta Crystallographica, Section B: Structural Science, 2002, 58, 553-563
2103107 CIF
Paper
C20 H18 Cl4 N2P -114.064; 8.9554; 18.117
118.407; 90.832; 76.46
1938.8Britton, Doyle
Planar packing of tetrachlorodicyanobenzene isomers
Acta Crystallographica, Section B: Structural Science, 2002, 58, 553-563
2103108 CIF
Paper
C20 H18 Cl4 N2P -17.513; 8.615; 9.029
114.24; 113.3; 91.92
475.8Britton, Doyle
Planar packing of tetrachlorodicyanobenzene isomers
Acta Crystallographica, Section B: Structural Science, 2002, 58, 553-563
2103109 CIF
Paper
C20 H18 Cl4 N2P -17.5567; 8.8956; 8.9921
116.697; 112.099; 92.101
484.66Britton, Doyle
Planar packing of tetrachlorodicyanobenzene isomers
Acta Crystallographica, Section B: Structural Science, 2002, 58, 553-563
2103110 CIF
Paper
C20 H18 Cl4 N2C 1 2/m 19.754; 15.41; 7.555
90; 116.88; 90
1012.9Britton, Doyle
Planar packing of tetrachlorodicyanobenzene isomers
Acta Crystallographica, Section B: Structural Science, 2002, 58, 553-563
2103111 CIF
Paper
C20 H18 Cl4 N2P -17.4982; 9.0371; 15.4538
85.08; 81.795; 71.168
980.1Britton, Doyle
Planar packing of tetrachlorodicyanobenzene isomers
Acta Crystallographica, Section B: Structural Science, 2002, 58, 553-563
2103112 CIF
Paper
C14 H14 Cl5 N4 P3P 1 21/n 111.125; 8.1671; 23.585
90; 99.61; 90
2112.9Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kılıç, Adem; Mayer, Thomas A.; Shaw, Robert A.; Uslu, Aylin
Structural investigations of phosphorus‒nitrogen compounds. 4. Steric and electronic effects in dibenzylamino derivatives of hexachlorocyclotriphosphazatriene and 4,4,6,6-tetrachloro-2,2-diphenylcyclotriphosphazatriene
Acta Crystallographica, Section B: Structural Science, 2002, 58, 545-552
2103113 CIF
Paper
C28 H28 Cl4 N5 P3P b c a18.294; 17.411; 19.047
90; 90; 90
6067Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kılıç, Adem; Mayer, Thomas A.; Shaw, Robert A.; Uslu, Aylin
Structural investigations of phosphorus‒nitrogen compounds. 4. Steric and electronic effects in dibenzylamino derivatives of hexachlorocyclotriphosphazatriene and 4,4,6,6-tetrachloro-2,2-diphenylcyclotriphosphazatriene
Acta Crystallographica, Section B: Structural Science, 2002, 58, 545-552
2103114 CIF
Paper
C26 H24 Cl3 N4 P3P 1 n 111.657; 8.5838; 13.783
90; 96.41; 90
1370.5Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kılıç, Adem; Mayer, Thomas A.; Shaw, Robert A.; Uslu, Aylin
Structural investigations of phosphorus‒nitrogen compounds. 4. Steric and electronic effects in dibenzylamino derivatives of hexachlorocyclotriphosphazatriene and 4,4,6,6-tetrachloro-2,2-diphenylcyclotriphosphazatriene
Acta Crystallographica, Section B: Structural Science, 2002, 58, 545-552
2103115 CIF
Paper
C40 H38 Cl2 N5 P3P 1 21/n 110.281; 21.0219; 17.3783
90; 99.047; 90
3709.18Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kılıç, Adem; Mayer, Thomas A.; Shaw, Robert A.; Uslu, Aylin
Structural investigations of phosphorus‒nitrogen compounds. 4. Steric and electronic effects in dibenzylamino derivatives of hexachlorocyclotriphosphazatriene and 4,4,6,6-tetrachloro-2,2-diphenylcyclotriphosphazatriene
Acta Crystallographica, Section B: Structural Science, 2002, 58, 545-552
2103116 CIF
Paper
C5 H12 Cl4 N5 P3P 21 21 217.8379; 13.4076; 14.0752
90; 90; 90
1479.13Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kılıç, Adem; Mayer, Thomas A.; Shaw, Robert A.; Uslu, Aylin
Structural investigations of phosphorus‒nitrogen compounds. 4. Steric and electronic effects in dibenzylamino derivatives of hexachlorocyclotriphosphazatriene and 4,4,6,6-tetrachloro-2,2-diphenylcyclotriphosphazatriene
Acta Crystallographica, Section B: Structural Science, 2002, 58, 545-552
2103117 CIF
Paper
C9 H12 O4C m c 2110.474; 66.24; 6.662
90; 90; 90
4622Duncan, Laura L.; Patrick, Brian O.; Brock, Carolyn Pratt
Two phases of C~9~H~12~O~4~: why is the structure at 295K so complicated?
Acta Crystallographica, Section B: Structural Science, 2002, 58, 502-511
2103118 CIF
Paper
C9 H12 O4P m n b10.471; 26.24; 6.434
90; 90; 90
1767.8Duncan, Laura L.; Patrick, Brian O.; Brock, Carolyn Pratt
Two phases of C~9~H~12~O~4~: why is the structure at 295K so complicated?
Acta Crystallographica, Section B: Structural Science, 2002, 58, 502-511
2103119 CIF
Paper
C Ca O3P -15.7394; 4.9616; 7.97
89.999; 90.012; 89.996
226.96Bevan, D. J. M.; Rossmanith, Elisabeth; Mylrea, Darren K.; Ness, Sharon E.; Taylor, Max R.; Cuff, Chris
On the structure of aragonite – Lawrence Bragg revisited
Acta Crystallographica, Section B: Structural Science, 2002, 58, 448-456
2103120 CIF
Paper
C6 H10 O3C 1 2/c 117.383; 6.188; 12.361
90; 101.16; 90
1304.5Kálmán, Alajos; Fábián, László; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna
Novel predicted patterns of supramolecular self-assembly afforded by tetrameric R~4~^4^(12) rings of C~2~ symmetry in the crystal structures of 2-hydroxy-1-cyclopentanecarboxylic acid, 2-hydroxy-1- cyclohexanecarboxylic acid and 2-hydroxy-1-cycloheptanecarboxylic acid.
Acta Crystallographica, Section B, 2002, 58, 494-501
2103121 CIF
Paper
C7 H12 O3C 1 2/c 121.436; 5.974; 12.095
90; 97.7; 90
1534.9Kálmán, Alajos; Fábián, László; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna
Novel predicted patterns of supramolecular self-assembly afforded by tetrameric R~4~^4^(12) rings of C~2~ symmetry in the crystal structures of 2-hydroxy-1-cyclopentanecarboxylic acid, 2-hydroxy-1- cyclohexanecarboxylic acid and 2-hydroxy-1-cycloheptanecarboxylic acid.
Acta Crystallographica, Section B, 2002, 58, 494-501
2103122 CIF
Paper
C8 H14 O3I 1 2/c 122.876; 6.224; 11.793
90; 95.56; 90
1671.2Kálmán, Alajos; Fábián, László; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna
Novel predicted patterns of supramolecular self-assembly afforded by tetrameric R~4~^4^(12) rings of C~2~ symmetry in the crystal structures of 2-hydroxy-1-cyclopentanecarboxylic acid, 2-hydroxy-1- cyclohexanecarboxylic acid and 2-hydroxy-1-cycloheptanecarboxylic acid.
Acta Crystallographica, Section B, 2002, 58, 494-501
2103123 CIF
Paper
C24 H54 O3 Si3R -3 c :H10.0793; 10.0793; 48.409
90; 90; 120
4259.1Herbst-Irmer, Regine; Sheldrick, George M.
Refinement of obverse/reverse twins
Acta Crystallographica, Section B: Structural Science, 2002, 58, 477-481
2103124 CIF
Paper
C50 H121 Al3 F10 Li4 O5 Si9R 3 :H14.899; 14.899; 30.472
90; 90; 120
5857.9Herbst-Irmer, Regine; Sheldrick, George M.
Refinement of obverse/reverse twins
Acta Crystallographica, Section B: Structural Science, 2002, 58, 477-481
2103125 CIF
Paper
C5 H11 N4 O4 PP 1 21/n 15.8389; 19.3579; 8.0338
90; 97.203; 90
900.88Slouf, Miroslav; Holy, Antonin; Petricek, Vaclav; Cisarova, Ivana
Charge density study of hydrogen-[(2,4-diaminopyrimidin-1-io)methyl]phosphonate monohydrate
Acta Crystallographica, Section B, 2002, 58, 519-529
2103126 CIF
Paper
C14 H26 N2 O10P 15.8757; 7.8751; 10.6165
70.345; 74.5; 87.435
445.24Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher
Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines
Acta Crystallographica, Section B, 2002, 58, 530-544
2103127 CIF
Paper
C14 H14 N2 O5P 15.1647; 6.2749; 10.2126
83.235; 89.808; 79.601
323.21Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher
Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines
Acta Crystallographica, Section B, 2002, 58, 530-544
2103128 CIF
Paper
C28 H28 N4 O10C 1 2 120.5; 4.6656; 14.201
90; 99.68; 90
1338.9Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher
Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines
Acta Crystallographica, Section B, 2002, 58, 530-544
2103129 CIF
Paper
C14 H14 N2 O5P 1 21/c 114.1274; 4.7459; 20.1749
90; 100.565; 90
1329.74Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher
Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines
Acta Crystallographica, Section B, 2002, 58, 530-544
2103130 CIF
Paper
C16 H16 N2 O5P 14.9325; 8.3343; 9.3502
72.751; 89.414; 80.207
361.41Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher
Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines
Acta Crystallographica, Section B, 2002, 58, 530-544
2103131 CIF
Paper
C16 H16 N2 O5P -14.9566; 8.4178; 9.2538
73.213; 89.915; 79.75
363.24Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher
Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines
Acta Crystallographica, Section B, 2002, 58, 530-544
2103132 CIF
Paper
C14 H24 N2 O10P 1 21/c 112.7309; 20.9103; 12.54
90; 95.178; 90
3324.61Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher
Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines
Acta Crystallographica, Section B, 2002, 58, 530-544
2103133 CIF
Paper
B6 CeP m -3 m4.1367; 4.1367; 4.1367
90; 90; 90
70.788Tanaka, Kiyoaki; Ōnuki, Yoshichika
Observation of 4<i>f</i> electron transfer from Ce to B~6~ in the Kondo crystal CeB~6~ and its mechanism by multi-temperature X-ray diffraction
Acta Crystallographica, Section B: Structural Science, 2002, 58, 423-436
2103134 CIF
Paper
B6 CeP m -3 m4.1381; 4.1381; 4.1381
90; 90; 90
70.862Tanaka, Kiyoaki; Ōnuki, Yoshichika
Observation of 4<i>f</i> electron transfer from Ce to B~6~ in the Kondo crystal CeB~6~ and its mechanism by multi-temperature X-ray diffraction
Acta Crystallographica, Section B: Structural Science, 2002, 58, 423-436
2103135 CIF
Paper
B6 CeP m -3 m4.1391; 4.1391; 4.1391
90; 90; 90
70.914Tanaka, Kiyoaki; Ōnuki, Yoshichika
Observation of 4<i>f</i> electron transfer from Ce to B~6~ in the Kondo crystal CeB~6~ and its mechanism by multi-temperature X-ray diffraction
Acta Crystallographica, Section B: Structural Science, 2002, 58, 423-436
2103136 CIF
Paper
B6 CeP m -3 m4.1407; 4.1407; 4.1407
90; 90; 90
70.996Tanaka, Kiyoaki; Ōnuki, Yoshichika
Observation of 4<i>f</i> electron transfer from Ce to B~6~ in the Kondo crystal CeB~6~ and its mechanism by multi-temperature X-ray diffraction
Acta Crystallographica, Section B: Structural Science, 2002, 58, 423-436
2103137 CIF
Paper
C14 H24 N2 O5P 21 21 215.6595; 8.3306; 33.022
90; 90; 90
1556.9Görbitz, Carl Henrik
b Turns, water cage formation and hydrogen bonding in the structures of L-Valyl-L-phenylalanine
Acta Crystallographica, Section B, 2002, 58, 512-518
2103138 CIF
Paper
C14 H26 N2 O6P 1 21 110.3137; 45.2095; 15.5891
90; 105.171; 90
7015.5Görbitz, Carl Henrik
b Turns, water cage formation and hydrogen bonding in the structures of L-Valyl-L-phenylalanine
Acta Crystallographica, Section B, 2002, 58, 512-518
2103139 CIF
Paper
C74 H16 CrP -113.6414; 13.8338; 13.8548
91.83; 116.776; 119.333
1924.78Hönnerscheid, Andreas; Dinnebier, Robert; Jansen, Martin
Reversible dimerization of C~60~ molecules in the crystal structure of the bis(arene)chromium fulleride [Cr(C~7~H~8~)]~2~C~60~
Acta Crystallographica, Section B: Structural Science, 2002, 58, 482-488
2103140 CIF
Paper
C48 H92 O6P -111.89979; 46.3879; 5.43998
72.359; 100.211; 121.125
2448.94Helmholdt, Robert B.; Peschar, René; Schenk, Henk
Structure of C~15~-, C~17~- and C~19~-mono-acid β-triacylglycerols
Acta Crystallographica Section B, 2002, 58, 134-139
2103141 CIF
Paper
C54 H104 O6P -111.86642; 51.4495; 5.43208
72.765; 100.095; 120.577
2725.82Helmholdt, Robert B.; Peschar, René; Schenk, Henk
Structure of C~15~-, C~17~- and C~19~-mono-acid β-triacylglycerols
Acta Crystallographica Section B, 2002, 58, 134-139
2103142 CIF
Paper
C60 H116 O6P -111.86797; 56.5143; 5.42795
73.064; 100.02; 120.084
3011.82Helmholdt, Robert B.; Peschar, René; Schenk, Henk
Structure of C~15~-, C~17~- and C~19~-mono-acid β-triacylglycerols
Acta Crystallographica Section B, 2002, 58, 134-139
2103143 CIF
Paper
C10.77 H8 N0.77 S8.77P b c m6.638; 8.309; 28.776
90; 90; 90
1587.1Kazheva, Olga N.; Canadell, Enric; Aleksandrov, Grigorii G.; Kushch, Nataliya D.; Dyachenko, Oleg A.
Quasi-three-dimensional network of molecular interactions and electronic structure of a new organic semiconductor, ET(NCS)~0.77~
Acta Crystallographica Section B, 2002, 58, 148-152
2103144 CIF
HKL
Paper
C6 H3 Cl N2 O2P 1 21/n 17.973; 7.0579; 12.389
90; 92.683; 90
696.4Pink, Maren; Britton, Doyle
5-Chloro- and 5-bromobenzfurazan 1-oxide revisited
Acta Crystallographica Section B, 2002, 58, 116-124
2103145 CIF
HKL
Paper
C6 H3 Cl N2 O2P 1 21/n 17.8317; 7.0527; 12.2576
90; 93.612; 90
675.7Pink, Maren; Britton, Doyle
5-Chloro- and 5-bromobenzfurazan 1-oxide revisited
Acta Crystallographica Section B, 2002, 58, 116-124

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