Crystallography Open Database

Result: there are 468 entries in the selection

Switch to the old layout of the page

Download all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)

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

Blue left arrow Blue left arrow First | Blue left arrow Previous 20 | of 24 | Next 20 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

COD ID Blue up arrow Links Formula Up arrow Space group Up arrow Cell parameters Cell volume Up arrow Bibliography
2103457 CIF
HKL
Paper
K2 O12 P3 Ti YbP 21 310.0939; 10.0939; 10.0939
90; 90; 90
1028.44Norberg, Stefan T.
New phosphate langbeinites, K~2~<i>M</i>Ti(PO~4~)~3~ (<i>M</i> = Er, Yb or Y), and an alternative description of the langbeinite framework
Acta Crystallographica Section B, 2002, 58, 743-749
2103458 CIF
HKL
Paper
K2 O12 P3 Ti YP 21 310.1318; 10.1318; 10.1318
90; 90; 90
1040.06Norberg, Stefan T.
New phosphate langbeinites, K~2~<i>M</i>Ti(PO~4~)~3~ (<i>M</i> = Er, Yb or Y), and an alternative description of the langbeinite framework
Acta Crystallographica Section B, 2002, 58, 743-749
2103459 CIF
HKL
Paper
Cr K2 O12 P3 TiP 21 39.8001; 9.8001; 9.8001
90; 90; 90
941.22Norberg, Stefan T.
New phosphate langbeinites, K~2~<i>M</i>Ti(PO~4~)~3~ (<i>M</i> = Er, Yb or Y), and an alternative description of the langbeinite framework
Acta Crystallographica Section B, 2002, 58, 743-749
2103460 CIF
HKL
Paper
H8 N2 O8 S2P 1 21/n 16.134; 7.9324; 7.7541
90; 94.966; 90
375.88Schmidt, Thorsten; Schmitt, Heike; Zimmermann, Herbert; Haeberlen, Ulrich; Lalowicz, Zdzisław T.; Olejniczak, Zbigniew; Oeser, Thomas
Location of the H atoms in ammonium persulphate by deuteron NMR. Verification by X-ray diffraction
Acta Crystallographica Section B, 2002, 58, 760-769
2103461 CIF
HKL
Paper
C51 H64 O4P 1 2/c 117.8141; 13.89; 17.806
90; 89.91; 90
4405.9Enright, Gary D.; Brouwer, Eric B.; Udachin, Konstantin A.; Ratcliffe, Christopher I.; Ripmeester, John A.
A reexamination of the low-temperature crystal structure of the <i>p-tert</i>-butylcalix[4]arene‒toluene inclusion compound. Differences in spatial averaging with Cu and Mo<i>K</i>α radiation
Acta Crystallographica Section B, 2002, 58, 1032-1035
2103462 CIF
HKL
Paper
C10 H13 N O3P 1 21/c 112.421; 12.056; 13.396
90; 91.51; 90
2005.3Oswald, Iain D. H.; Allan, David R.; McGregor, Pamela A.; Motherwell, W. D. Samuel; Parsons, Simon; Pulham, Colin R.
The formation of paracetamol (acetaminophen) adducts with hydrogen-bond acceptors
Acta Crystallographica Section B, 2002, 58, 1057-1066
2103463 CIF
HKL
Paper
C22 H32 N4 O4P 1 21/c 110.697; 11.024; 9.4896
90; 100.684; 90
1099.65Oswald, Iain D. H.; Allan, David R.; McGregor, Pamela A.; Motherwell, W. D. Samuel; Parsons, Simon; Pulham, Colin R.
The formation of paracetamol (acetaminophen) adducts with hydrogen-bond acceptors
Acta Crystallographica Section B, 2002, 58, 1057-1066
2103464 CIF
HKL
Paper
C21 H29 N3 O5P 1 21/c 110.5749; 11.0221; 9.3894
90; 101.145; 90
1073.77Oswald, Iain D. H.; Allan, David R.; McGregor, Pamela A.; Motherwell, W. D. Samuel; Parsons, Simon; Pulham, Colin R.
The formation of paracetamol (acetaminophen) adducts with hydrogen-bond acceptors
Acta Crystallographica Section B, 2002, 58, 1057-1066
2103465 CIF
HKL
Paper
C20 H28 N4 O4P 1 21/c 115.893; 5.1664; 12.993
90; 113.633; 90
977.4Oswald, Iain D. H.; Allan, David R.; McGregor, Pamela A.; Motherwell, W. D. Samuel; Parsons, Simon; Pulham, Colin R.
The formation of paracetamol (acetaminophen) adducts with hydrogen-bond acceptors
Acta Crystallographica Section B, 2002, 58, 1057-1066
2103466 CIF
HKL
Paper
C18 H17 N3 O2P 1 21/c 111.2906; 24.103; 11.5526
90; 96.1484; 90
3125.8Oswald, Iain D. H.; Allan, David R.; McGregor, Pamela A.; Motherwell, W. D. Samuel; Parsons, Simon; Pulham, Colin R.
The formation of paracetamol (acetaminophen) adducts with hydrogen-bond acceptors
Acta Crystallographica Section B, 2002, 58, 1057-1066
2103467 CIF
HKL
Paper
C20 H27 N3 O5P 21 21 217.2791; 14.6277; 18.303
90; 90; 90
1948.8Oswald, Iain D. H.; Allan, David R.; McGregor, Pamela A.; Motherwell, W. D. Samuel; Parsons, Simon; Pulham, Colin R.
The formation of paracetamol (acetaminophen) adducts with hydrogen-bond acceptors
Acta Crystallographica Section B, 2002, 58, 1057-1066
2103468 CIF
HKL
Paper
Al2 Mn3 O12 Si3I a -3 d11.63; 11.63; 11.63
90; 90; 90
1573Gramaccioli, Carlo Maria; Pilati, Tullio; Demartin, Francesco
Atomic displacement parameters for spessartine Mn~3~Al~2~Si~3~O~12~ and their lattice-dynamical interpretation
Acta Crystallographica Section B, 2002, 58, 965-969
2103469 CIF
Paper
Hg I2I 41/a m d :28.7863; 8.7863; 24.667
90; 90; 90
1904.3Hostettler, Marc; Birkedal, Henrik; Schwarzenbach, Dieter
The structure of orange HgI~2~. I. Polytypic layer structure
Acta Crystallographica Section B, 2002, 58, 903-913
2103470 CIF
Paper
Hg I2P 42/n m c :28.7863; 8.7863; 12.334
90; 90; 90
952.2Hostettler, Marc; Birkedal, Henrik; Schwarzenbach, Dieter
The structure of orange HgI~2~. I. Polytypic layer structure
Acta Crystallographica Section B, 2002, 58, 903-913
2103471 CIF
Paper
Hg I2I 41/a c d :212.393; 12.393; 24.889
90; 90; 90
3822.6Hostettler, Marc; Schwarzenbach, Dieter
The structure of orange HgI~2~. II. Diamond-type structure and twinning
Acta Crystallographica Section B, 2002, 58, 914-920
2103472 CIF
HKL
Paper
C6 H6 OP 1 21 111.61; 5.4416; 12.217
90; 101.47; 90
756.4Allan, David R.; Clark, Stewart J.; Dawson, Alice; McGregor, Pamela A.; Parsons, Simon
Pressure-induced polymorphism in phenol
Acta Crystallographica Section B, 2002, 58, 1018-1024
2103473 CIF
HKL
Paper
C20 H26 Cl2 N3 O5 P3P 1 21/n 117.618; 8.1109; 19.284
90; 114.44; 90
2508.7Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kılıç, Adem; Mayer, Thomas A.; Shaw, Robert A.
Structural investigations of phosphorus–nitrogen compounds. 5. Relationships between molecular parameters of 2,2-diphenyl-4,6-<i>cis</i>-oxytetra(ethyleneoxy)-4,6-<i>R</i>~2~-cyclotriphosphazatrienes (<i>R</i> = Cl, OCH~2~CF~3~, OPh, OMe, NHPh, NHBu^<i>t^</i>) and substituent basicity constants
Acta Crystallographica Section B, 2002, 58, 1067-1073
2103474 CIF
HKL
Paper
C24 H30 F6 N3 O7 P3P 1 21/n 115.3839; 8.0685; 24.1935
90; 105.877; 90
2888.46Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kılıç, Adem; Mayer, Thomas A.; Shaw, Robert A.
Structural investigations of phosphorus‒nitrogen compounds. 5. Relationships between molecular parameters of 2,2-diphenyl-4,6-<i>cis</i>-oxytetra(ethyleneoxy)-4,6-<i>R</i>~2~-cyclotriphosphazatrienes (<i>R</i> = Cl, OCH~2~CF~3~, OPh, OMe, NHPh, NHBu^<i>t^</i>) and substituent basicity constants
Acta Crystallographica Section B, 2002, 58, 1067-1073
2103475 CIF
HKL
Paper
C32 H36 N3 O7 P3P 110.166; 12.105; 13.313
88.86; 86.54; 78.14
1600.3Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kılıç, Adem; Mayer, Thomas A.; Shaw, Robert A.
Structural investigations of phosphorus–nitrogen compounds. 5. Relationships between molecular parameters of 2,2-diphenyl-4,6-<i>cis</i>-oxytetra(ethyleneoxy)-4,6-<i>R</i>~2~-cyclotriphosphazatrienes (<i>R</i> = Cl, OCH~2~CF~3~, OPh, OMe, NHPh, NHBu^<i>t^</i>) and substituent basicity constants
Acta Crystallographica Section B, 2002, 58, 1067-1073
2103476 CIF
HKL
Paper
C22 H32 N3 O7 P3P 1 21/n 111.8293; 10.3312; 21.6318
90; 100.203; 90
2601.84Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kılıç, Adem; Mayer, Thomas A.; Shaw, Robert A.
Structural investigations of phosphorus‒nitrogen compounds. 5. Relationships between molecular parameters of 2,2-diphenyl-4,6-<i>cis</i>-oxytetra(ethyleneoxy)-4,6-<i>R</i>~2~-cyclotriphosphazatrienes (<i>R</i> = Cl, OCH~2~CF~3~, OPh, OMe, NHPh, NHBu^<i>t^</i>) and substituent basicity constants
Acta Crystallographica Section B, 2002, 58, 1067-1073

Blue left arrow Blue left arrow First | Blue left arrow Previous 20 | of 24 | Next 20 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

Back to the search form
Your own data is not in the COD? Deposit it, thanks!