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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2102796 CIF
Paper
C13 H9 Br OP 1 21/c 112.124; 14.646; 6.1585
90; 97.38; 90
1084.5Strzhemechny, Mikhail A.; Baumer, Vyacheslav N.; Avdeenko, Anatoli A.; Pyshkin, Oleg S.; Romashkin, Roman V.; Buravtseva, Lyubov M.
Polymorphism of 4-bromobenzophenone
Acta Crystallographica Section B, 2007, 63, 296-302
2102797 CIF
Paper
C13 H9 Br OP 1 21/c 112.092; 14.343; 6.1243
90; 97.26; 90
1053.7Strzhemechny, Mikhail A.; Baumer, Vyacheslav N.; Avdeenko, Anatoli A.; Pyshkin, Oleg S.; Romashkin, Roman V.; Buravtseva, Lyubov M.
Polymorphism of 4-bromobenzophenone
Acta Crystallographica Section B, 2007, 63, 296-302
2102798 CIF
Paper
C13 H9 Br OP -16.1056; 7.2931; 12.0999
98.197; 98.735; 91.111
526.64Strzhemechny, Mikhail A.; Baumer, Vyacheslav N.; Avdeenko, Anatoli A.; Pyshkin, Oleg S.; Romashkin, Roman V.; Buravtseva, Lyubov M.
Polymorphism of 4-bromobenzophenone
Acta Crystallographica Section B, 2007, 63, 296-302
2102799 CIF
Paper
As3 Cs O8C 1 2/c 18.515; 11.69; 7.595
90; 112.7; 90
697.4Schwendtner, Karolina; Kolitsch, Uwe
Octahedral As in <i>M</i>^+^ arsenates ‒ architecture and seven new members
Acta Crystallographica Section B, 2007, 63, 205-215
2102800 CIF
Paper
As4 H3 K O12P -15.154; 6.967; 7.532
63.9; 78.61; 84.35
238.08Schwendtner, Karolina; Kolitsch, Uwe
Octahedral As in <i>M</i>^+^ arsenates ‒ architecture and seven new members
Acta Crystallographica Section B, 2007, 63, 205-215
2102801 CIF
Paper
As2 H K O6P 1 21/c 16.051; 9.727; 9.054
90; 94.21; 90
531.46Schwendtner, Karolina; Kolitsch, Uwe
Octahedral As in <i>M</i>^+^ arsenates ‒ architecture and seven new members
Acta Crystallographica Section B, 2007, 63, 205-215
2102802 CIF
Paper
As3 H2 Li O9P 1 21/n 19.666; 8.553; 9.97
90; 117.86; 90
728.7Schwendtner, Karolina; Kolitsch, Uwe
Octahedral As in <i>M</i>^+^ arsenates ‒ architecture and seven new members
Acta Crystallographica Section B, 2007, 63, 205-215
2102803 CIF
Paper
As4 H6 Li2 O14C 1 2/m 111.456; 9.133; 5.63
90; 115.56; 90
531.4Schwendtner, Karolina; Kolitsch, Uwe
Octahedral As in <i>M</i>^+^ arsenates ‒ architecture and seven new members
Acta Crystallographica Section B, 2007, 63, 205-215
2102804 CIF
Paper
As4 H3 O12 RbP -15.169; 7.036; 7.766
63.31; 79.87; 84.38
248.36Schwendtner, Karolina; Kolitsch, Uwe
Octahedral As in <i>M</i>^+^ arsenates ‒ architecture and seven new members
Acta Crystallographica Section B, 2007, 63, 205-215
2102805 CIF
HKL
Paper
Ag As3 H2 O9P -17.162; 7.678; 7.88
110.72; 106.47; 105.43
354.8Schwendtner, Karolina; Kolitsch, Uwe
Octahedral As in <i>M</i>^+^ arsenates ‒ architecture and seven new members
Acta Crystallographica Section B, 2007, 63, 205-215
2102806 CIF
Paper
Br3 Cs EuP b n m8.242; 8.3027; 11.785
90; 90; 90
806.5Ehrenberg, Helmut; Fuess, Hartmut; Hesse, Sabine; Zimmermann, Joerg; von Seggern, Heinz; Knapp, Michael
Structures of CsEuBr~3~ and its degradation product Cs~2~EuBr~5~·10H~2~O
Acta Crystallographica Section B, 2007, 63, 201-204
2102807 CIF
Paper
Br5 Cs2 Eu H20 O10P b c m8.047; 13.998; 19.558
90; 90; 90
2203.1Ehrenberg, Helmut; Fuess, Hartmut; Hesse, Sabine; Zimmermann, Joerg; von Seggern, Heinz; Knapp, Michael
Structures of CsEuBr~3~ and its degradation product Cs~2~EuBr~5~·10H~2~O
Acta Crystallographica Section B, 2007, 63, 201-204
2102808 CIF
Paper
C13 H13 N O4P -110.6031; 11.5968; 5.5032
97.879; 103.891; 71.457
621.434Ľubomír Smrčok; Vladimír Jorík; Eva Scholtzovaá; Viktor Milata
<i>Ab initio</i> structure determination of 5-anilinomethylene-2,2-dimethyl-1,3-dioxane-4,6-dione from laboratory powder data – a combined use of X-ray, molecular and solid-state DFT study
Acta Crystallographica Section B, 2007, 63, 477-484
2102809 CIF
Paper
C6 H12 N2 O8P 1 21/n 14.934; 9.955; 10.854
90; 97.44; 90
528.6Chitra, R.; Choudhury, R. R
Investigation of hydrogen-bond network in bis(glycinium) oxalate using single-crystal neutron diffraction and spectroscopic studies
Acta Crystallographica Section B, 2007, 63, 497-504
2102810 CIF
Paper
C10 H20 N4 O8P -15.4876; 10.021; 13.868
109.079; 94.378; 94.538
714.2Selvaraj, M.; Thamotharan, S.; Roy, Siddhartha; Vijayan, M.
X-ray studies of crystalline complexes involving amino acids and peptides. XLIV. Invariant features of supramolecular association and chiral effects in the complexes of arginine and lysine with tartaric acid
Acta Crystallographica Section B, 2007, 63, 459-468
2102811 CIF
Paper
C16 H34 N8 O10P 1 21 19.907; 8.7428; 14.076
90; 109.412; 90
1149.9Selvaraj, M.; Thamotharan, S.; Roy, Siddhartha; Vijayan, M.
X-ray studies of crystalline complexes involving amino acids and peptides. XLIV. Invariant features of supramolecular association and chiral effects in the complexes of arginine and lysine with tartaric acid
Acta Crystallographica Section B, 2007, 63, 459-468
2102812 CIF
Paper
C16 H36 N4 O11P 1 21/c 110.087; 23.003; 9.414
90; 90.82; 90
2184.1Selvaraj, M.; Thamotharan, S.; Roy, Siddhartha; Vijayan, M.
X-ray studies of crystalline complexes involving amino acids and peptides. XLIV. Invariant features of supramolecular association and chiral effects in the complexes of arginine and lysine with tartaric acid
Acta Crystallographica Section B, 2007, 63, 459-468
2102813 CIF
Paper
C10 H20 N2 O8P 1 21 15.1849; 16.667; 7.6701
90; 96.366; 90
658.7Selvaraj, M.; Thamotharan, S.; Roy, Siddhartha; Vijayan, M.
X-ray studies of crystalline complexes involving amino acids and peptides. XLIV. Invariant features of supramolecular association and chiral effects in the complexes of arginine and lysine with tartaric acid
Acta Crystallographica Section B, 2007, 63, 459-468
2102814 CIF
Paper
C10 H20 N2 O8P 1 21 15.1022; 17.444; 7.547
90; 97.748; 90
665.6Selvaraj, M.; Thamotharan, S.; Roy, Siddhartha; Vijayan, M.
X-ray studies of crystalline complexes involving amino acids and peptides. XLIV. Invariant features of supramolecular association and chiral effects in the complexes of arginine and lysine with tartaric acid
Acta Crystallographica Section B, 2007, 63, 459-468
2102815 CIF
Paper
C2 H2 Cs2 O5C 1 2/c 110.0748; 6.6473; 11.2997
90; 107.189; 90
722.94Weller, Mark T.; Henry, Paul F.; Light, Mark E.
Rapid structure determination of the hydrogen-containing compound Cs~2~C~2~O~4~·H~2~O by joint single-crystal X-ray and powder neutron diffraction
Acta Crystallographica Section B, 2007, 63, 426-432
2102816 CIF
Paper
C2 H2 Cs2 O5C 1 2/c 110.1127; 6.6535; 11.3257
90; 107.19; 90
728Weller, Mark T.; Henry, Paul F.; Light, Mark E.
Rapid structure determination of the hydrogen-containing compound Cs~2~C~2~O~4~·H~2~O by joint single-crystal X-ray and powder neutron diffraction
Acta Crystallographica Section B, 2007, 63, 426-432
2102817 CIF
Paper
C2 H2 Cs2 O5C 1 2/c 110.075; 6.6473; 11.2997
90; 107.189; 90
722.9Weller, Mark T.; Henry, Paul F.; Light, Mark E.
Rapid structure determination of the hydrogen-containing compound Cs~2~C~2~O~4~·H~2~O by joint single-crystal X-ray and powder neutron diffraction
Acta Crystallographica Section B, 2007, 63, 426-432
2102818 CIF
Paper
C2 H2 Cs2 O5C 1 2/c 110.1125; 6.6535; 11.3255
90; 107.191; 90
727.98Weller, Mark T.; Henry, Paul F.; Light, Mark E.
Rapid structure determination of the hydrogen-containing compound Cs~2~C~2~O~4~·H~2~O by joint single-crystal X-ray and powder neutron diffraction
Acta Crystallographica Section B, 2007, 63, 426-432
2102819 CIF
Paper
C6 H13 N O3 SP 1 2/c 18.1711; 10.9972; 9.4601
90; 91.575; 90
849.76Leban, Ivan; Rudan-Tasic, Darja; Lah, Nina; Klofutar, Cveto
Structures of artificial sweeteners – cyclamic acid and sodium cyclamate with other cyclamates
Acta Crystallographica Section B, 2007, 63, 418-425
2102820 CIF
Paper
C6 H12 N Na O3 SC 1 2/c 131.083; 6.2718; 8.5682
90; 94.481; 90
1665.2Leban, Ivan; Rudan-Tasic, Darja; Lah, Nina; Klofutar, Cveto
Structures of artificial sweeteners ‒ cyclamic acid and sodium cyclamate with other cyclamates
Acta Crystallographica Section B, 2007, 63, 418-425
2102821 CIF
Paper
C6 H12 K N O3 SC 1 2/c 133.656; 6.274; 8.572
90; 93.35; 90
1807Leban, Ivan; Rudan-Tasic, Darja; Lah, Nina; Klofutar, Cveto
Structures of artificial sweeteners – cyclamic acid and sodium cyclamate with other cyclamates
Acta Crystallographica Section B, 2007, 63, 418-425
2102822 CIF
Paper
C6 H16 N2 O3 SC 1 2/c 133.6671; 6.4571; 8.7572
90; 92.961; 90
1901.2Leban, Ivan; Rudan-Tasic, Darja; Lah, Nina; Klofutar, Cveto
Structures of artificial sweeteners – cyclamic acid and sodium cyclamate with other cyclamates
Acta Crystallographica Section B, 2007, 63, 418-425
2102823 CIF
Paper
C6 H12 N O3 Rb SC 1 2/c 134.039; 6.451; 8.811
90; 92.67; 90
1932.7Leban, Ivan; Rudan-Tasic, Darja; Lah, Nina; Klofutar, Cveto
Structures of artificial sweeteners ‒ cyclamic acid and sodium cyclamate with other cyclamates
Acta Crystallographica Section B, 2007, 63, 418-425
2102824 CIF
Paper
C18 H40 N2 O3 SP 1 21/n 110.951; 13.5112; 14.6202
90; 99.425; 90
2134Leban, Ivan; Rudan-Tasic, Darja; Lah, Nina; Klofutar, Cveto
Structures of artificial sweeteners – cyclamic acid and sodium cyclamate with other cyclamates
Acta Crystallographica Section B, 2007, 63, 418-425
2102825 CIF
Paper
C14 H10 Br N3C 1 c 14.2021; 21.0409; 14.3803
90; 96.248; 90
1263.9Ojala, William H.; Smieja, Jonathan M.; Spude, Jill M.; Arola, Trina M.; Kuspa, Marika K.; Herrera, Nell; Ojala, Charles R.
Isostructuralism among `bridge-flipped' isomeric benzylideneanilines and phenylhydrazones
Acta Crystallographica Section B, 2007, 63, 485-496
2102826 CIF
Paper
C14 H10 Br N3C 1 c 14.4902; 19.9376; 14.3182
90; 92.884; 90
1280.2Ojala, William H.; Smieja, Jonathan M.; Spude, Jill M.; Arola, Trina M.; Kuspa, Marika K.; Herrera, Nell; Ojala, Charles R.
Isostructuralism among `bridge-flipped' isomeric benzylideneanilines and phenylhydrazones
Acta Crystallographica Section B, 2007, 63, 485-496
2102827 CIF
Paper
C15 H12 F3 NP 1 21/c 19.6046; 7.7953; 17.2756
90; 104.316; 90
1253.27Ojala, William H.; Smieja, Jonathan M.; Spude, Jill M.; Arola, Trina M.; Kuspa, Marika K.; Herrera, Nell; Ojala, Charles R.
Isostructuralism among `bridge-flipped' isomeric benzylideneanilines and phenylhydrazones
Acta Crystallographica Section B, 2007, 63, 485-496
2102828 CIF
Paper
C15 H12 F3 NP 1 21/c 19.7556; 7.8003; 16.8794
90; 102.647; 90
1253.3Ojala, William H.; Smieja, Jonathan M.; Spude, Jill M.; Arola, Trina M.; Kuspa, Marika K.; Herrera, Nell; Ojala, Charles R.
Isostructuralism among `bridge-flipped' isomeric benzylideneanilines and phenylhydrazones
Acta Crystallographica Section B, 2007, 63, 485-496
2102829 CIF
Paper
C14 H12 Br NP b c n13.4669; 11.7471; 14.9271
90; 90; 90
2361.4Ojala, William H.; Smieja, Jonathan M.; Spude, Jill M.; Arola, Trina M.; Kuspa, Marika K.; Herrera, Nell; Ojala, Charles R.
Isostructuralism among `bridge-flipped' isomeric benzylideneanilines and phenylhydrazones
Acta Crystallographica Section B, 2007, 63, 485-496
2102830 CIF
Paper
C14 H12 Br NP b c n13.355; 11.6667; 14.9529
90; 90; 90
2329.8Ojala, William H.; Smieja, Jonathan M.; Spude, Jill M.; Arola, Trina M.; Kuspa, Marika K.; Herrera, Nell; Ojala, Charles R.
Isostructuralism among `bridge-flipped' isomeric benzylideneanilines and phenylhydrazones
Acta Crystallographica Section B, 2007, 63, 485-496
2102831 CIF
Paper
C15 H12 N2P 1 21/n 16.1535; 7.199; 26.253
90; 92.285; 90
1162.1Ojala, William H.; Smieja, Jonathan M.; Spude, Jill M.; Arola, Trina M.; Kuspa, Marika K.; Herrera, Nell; Ojala, Charles R.
Isostructuralism among `bridge-flipped' isomeric benzylideneanilines and phenylhydrazones
Acta Crystallographica Section B, 2007, 63, 485-496
2102832 CIF
Paper
C15 H12 N2P 1 21/n 16.1878; 7.3785; 25.895
90; 94.635; 90
1178.4Ojala, William H.; Smieja, Jonathan M.; Spude, Jill M.; Arola, Trina M.; Kuspa, Marika K.; Herrera, Nell; Ojala, Charles R.
Isostructuralism among `bridge-flipped' isomeric benzylideneanilines and phenylhydrazones
Acta Crystallographica Section B, 2007, 63, 485-496
2102833 CIF
Paper
C56 H62 Cu N4 O14 S2P 1 21/c 119.0356; 17.4332; 17.418
90; 113.824; 90
5287.7Dorokhov, Andrey V.; Chernyshov, Dmitrii Yu.; Burlov, Anatolii S.; Garnovskii, Alexandr D.; Ivanova, Irina S.; Pyatova, Elena N.; Tsivadze, Aslan Yu.; Aslanov, Leonid A.; Chernyshev, Vladimir V.
Synchrotron powder diffraction in a systematic study of 4'-[2-(tosylamino)benzylideneamino]-2,3-benzo-15-crown-5 complexes
Acta Crystallographica Section B, 2007, 63, 402-410
2102834 CIF
Paper
C29 H32 Li N3 O7 S2P 1 21/c 19.2918; 23.0117; 15.2798
90; 108.063; 90
3106.11Dorokhov, Andrey V.; Chernyshov, Dmitrii Yu.; Burlov, Anatolii S.; Garnovskii, Alexandr D.; Ivanova, Irina S.; Pyatova, Elena N.; Tsivadze, Aslan Yu.; Aslanov, Leonid A.; Chernyshev, Vladimir V.
Synchrotron powder diffraction in a systematic study of 4'-[2-(tosylamino)benzylideneamino]-2,3-benzo-15-crown-5 complexes
Acta Crystallographica Section B, 2007, 63, 402-410
2102835 CIF
Paper
C5 H10 N5 O5 PP 1 21/c 14.97; 12.7506; 15.0499
90; 92.293; 90
952.96Bendeif, El-Eulmi; Dahaoui, Slimane; Benali-Cherif, Nourredine; Lecomte, Claude
Tautomerism and hydrogen bonding in guaninium phosphite and guaninium phosphate salts
Acta Crystallographica Section B, 2007, 63, 448-458
2102836 CIF
Paper
C5 H12 N5 O6 PP 1 21/c 14.6812; 24.0561; 9.5186
90; 99.773; 90
1056.35Bendeif, El-Eulmi; Dahaoui, Slimane; Benali-Cherif, Nourredine; Lecomte, Claude
Tautomerism and hydrogen bonding in guaninium phosphite and guaninium phosphate salts
Acta Crystallographica Section B, 2007, 63, 448-458
2102837 CIF
Paper
C5 H10 N5 O6 PP 1 21/n 14.5414; 12.5774; 18.1485
90; 93.689; 90
1034.48Bendeif, El-Eulmi; Dahaoui, Slimane; Benali-Cherif, Nourredine; Lecomte, Claude
Tautomerism and hydrogen bonding in guaninium phosphite and guaninium phosphate salts
Acta Crystallographica Section B, 2007, 63, 448-458
2102838 CIF
Paper
B3 H Li Na O8 SiP 1 21/c 16.762; 13.8016; 7.6878
90; 124.089; 90
594.19Whitfield, Pamela S.; Le Page, Yvon; Grice, Joel D.; Stanley, Chris J.; Jones, Gary C.; Rumsey, Michael S.; Blake, Chris; Roberts, Andrew C.; Stirling, John A. R.; Carpenter, Gordon J. C.
LiNaSiB~3~O~7~(OH) – novel structure of the new borosilicate mineral jadarite determined from laboratory powder diffraction data
Acta Crystallographica Section B, 2007, 63, 396-401
2102839 CIF
Paper
Ce0.5 O2 Zr0.5P 42/n m c :13.7191; 3.7191; 5.3057
90; 90; 90
73.387Wakita, Takahiro; Yashima, Masatomo
<i>In situ</i> observation of the tetragonal‒cubic phase transition in the CeZrO~4~ solid solution ‒ a high-temperature neutron diffraction study
Acta Crystallographica Section B, 2007, 63, 384-389
2102840 CIF
Paper
Ce0.5 O2 Zr0.5P 42/n m c :13.7286; 3.7286; 5.3215
90; 90; 90
73.982Wakita, Takahiro; Yashima, Masatomo
<i>In situ</i> observation of the tetragonal‒cubic phase transition in the CeZrO~4~ solid solution ‒ a high-temperature neutron diffraction study
Acta Crystallographica Section B, 2007, 63, 384-389
2102841 CIF
Paper
Ce0.5 O2 Zr0.5P 42/n m c :13.7386; 3.7386; 5.3381
90; 90; 90
74.611Wakita, Takahiro; Yashima, Masatomo
<i>In situ</i> observation of the tetragonal‒cubic phase transition in the CeZrO~4~ solid solution ‒ a high-temperature neutron diffraction study
Acta Crystallographica Section B, 2007, 63, 384-389
2102842 CIF
Paper
Ce0.5 O2 Zr0.5P 42/n m c :13.7503; 3.7503; 5.3564
90; 90; 90
75.336Wakita, Takahiro; Yashima, Masatomo
<i>In situ</i> observation of the tetragonal‒cubic phase transition in the CeZrO~4~ solid solution ‒ a high-temperature neutron diffraction study
Acta Crystallographica Section B, 2007, 63, 384-389
2102843 CIF
Paper
Ce0.5 O2 Zr0.5P 42/n m c :13.764; 3.764; 5.3745
90; 90; 90
76.144Wakita, Takahiro; Yashima, Masatomo
<i>In situ</i> observation of the tetragonal‒cubic phase transition in the CeZrO~4~ solid solution ‒ a high-temperature neutron diffraction study
Acta Crystallographica Section B, 2007, 63, 384-389
2102844 CIF
Paper
Ce0.5 O2 Zr0.5P 42/n m c :13.7781; 3.7781; 5.3833
90; 90; 90
76.841Wakita, Takahiro; Yashima, Masatomo
<i>In situ</i> observation of the tetragonal‒cubic phase transition in the CeZrO~4~ solid solution ‒ a high-temperature neutron diffraction study
Acta Crystallographica Section B, 2007, 63, 384-389
2102845 CIF
Paper
Ce0.5 O2 Zr0.5F m -3 m5.3848; 5.3848; 5.3848
90; 90; 90
156.14Wakita, Takahiro; Yashima, Masatomo
<i>In situ</i> observation of the tetragonal‒cubic phase transition in the CeZrO~4~ solid solution ‒ a high-temperature neutron diffraction study
Acta Crystallographica Section B, 2007, 63, 384-389

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