Crystallography Open Database
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Searching journal of publication like 'Acta crystallographica Section B, Structural science, crystal engineering and materials'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
2107418 | CIF | C4 H10 Cl2 Hg N6 O4 | P 1 21/c 1 | 3.84; 18.394; 9.01 90; 110.2; 90 | 597.26 | Birker, P.J.M.W.L.; Freeman, H.C.; Guss, J.M.; Watson, A.D. Bis(biuret)mercury(II) Dichloride Acta Crystallographica B (24,1968-38,1982), 1977, 33, 182-184 |
2107419 | CIF | Be2 Cs F5 | P 41 3 2 | 7.936; 7.936; 7.936 90; 90; 90 | 499.81 | le Fur, Y.; Aleonard, S. Structure du pentafluorodiberyllate Cs Be2 F5 Acta Crystallographica B (24,1968-38,1982), 1972, 28, 2115-2118 |
2107420 | CIF | Ba2 Bi2 O6 | R -3 :R | 8.7094; 8.7094; 8.7094 90.265; 90.265; 90.265 | 660.619 | Cox, D.E.; Sleight, A.W. Mixed-valent Ba2 Bi(III) Bi(V) O6: Structure and properties vs temperature Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1-10 |
2107421 | CIF | Cr2 Fe H4 K O10 | C 1 2/m 1 | 10.857; 5.505; 10.374 90; 137.87; 90 | 415.926 | Gravereau, P.; Hardy, A.M. La serie M(I) M(III) (X O4)2 (H2 O)n: Structure cristalline de K Fe (Cr O4)2 (H2 O)2, nouveau type dans la serie des chromates des fer dihydrates Acta Crystallographica B (24,1968-38,1982), 1972, 28, 2333-2337 |
2107422 | CIF | C6 H3 Fe N6 | P -3 1 m | 6.513; 6.513; 5.78 90; 90; 120 | 212.335 | Haser, R.; Pierrot, M.; de Broin, C.E. Etude structurale de la serie des hexacyanoferrates(II,III) d'hydrogene: H3+x (Fe(II)x Fe(III)1-x (C N)6)(H2 O)y. I. Struct. cristall. des phases hexagonales H, H3 Fe(III) (C N)6 et H3 Co(III) (C N)6, par diffr. Acta Crystallographica B (24,1968-38,1982), 1972, 28, 2530-2537 |
2107423 | CIF | C6 H3 Co N6 | P -3 1 m | 6.432; 6.432; 5.701 90; 90; 120 | 204.255 | Haser, R.; Pierrot, M.; de Broin, C.E. Etude structurale de la serie des hexacyanoferrates(II,III) d'hydrogene: H3+x (Fe(II)x Fe(III)1-x (C N)6)(H2 O)y. I. Struct. cristall. des phases hexagonales H, H3 Fe(III) (C N)6 et H3 Co(III) (C N)6, par diffr. Acta Crystallographica B (24,1968-38,1982), 1972, 28, 2530-2537 |
2107424 | CIF | D10 O8 S | P -4 21 c | 7.482; 7.482; 6.353 90; 90; 90 | 355.643 | Kjaellman, T.; Olovsson, I. Hydrogen-Bond studies. LVIII. The crystal structure of normal and deuterated sulphuric acid tetrahydrate, ((H5 O2)(+))2 (S O4)(2-) and ((D5 O2)(+))2 (S O4)(2-) Acta Crystallographica B (24,1968-38,1982), 1972, 28, 1692-1697 |
2107425 | CIF | H10 O8 S | P -4 21 c | 7.484; 7.484; 6.349 90; 90; 90 | 355.609 | Kjaellman, T.; Olovsson, I. Hydrogen-bond studies. LVIII. The crystal structure of normal and deuterated sulphuric acid tetrahydrate, ((H5 O2)(+))2 (S O4)(2-) and ((D5 O2)(+))2 (S O4)(2-) Acta Crystallographica B (24,1968-38,1982), 1972, 28, 1692-1697 |
2107426 | CIF | C H6 Cl3 N2 O2 Re S | P c a 21 | 11.032; 7.083; 11.166 90; 90; 90 | 872.507 | Lis, T. trans-(Oxoaqua)trichlorothiourearhenium(V), Re O (H2 O) Cl3 Tu Acta Crystallographica B (24,1968-38,1982), 1977, 33, 944-946 |
2107427 | CIF | As2 H Na O6 | P 1 1 21/b | 5.829; 8.989; 9.154 90; 90; 93.29 | 478.851 | Nguyen, H.D.; Tahar, J. Hydrogenoarsenate de Sodium Na H As2 O6: Un Nouveau Type d'Anion Bidimensionnel Infini (As2 O6)n(2n-) Acta Crystallographica B (24,1968-38,1982), 1978, 34, 3727-3729 |
2107428 | CIF | Co O8 P2 Zn2 | P 1 21/n 1 | 7.536; 8.413; 5.049 90; 94.74; 90 | 319.014 | Nord, A.G. Crystallographic Studies of the Farringtonite-type Phases gamma-Zn2 Co (P O4)2 and gamma-(Zn.5 Co.5)3 (P O4)2 Acta Crystallographica B (39,1983-), 1984, 40, 191-194 |
2107429 | CIF | Co3 O16 P4 Zn3 | P 1 21/n 1 | 7.545; 8.406; 5.054 90; 94.56; 90 | 319.527 | Nord, A.G. Crystallographic Studies of the Farringtonite-type phases gamma-Zn2 Co (P O4)2 and gamma-(Zn.5 Co.5)3 (P O4)2 Acta Crystallographica B (39,1983-), 1984, 40, 191-194 |
2107430 | CIF | Ca2 K2 Na2 O40 Si16 Th2 | P 4/m c c | 7.58; 7.58; 14.77 90; 90; 90 | 848.631 | Richard, P.; Perrault, G. Structure cristalline de l'ekanite de St-Hilaire, P.Q. Acta Crystallographica B (24,1968-38,1982), 1972, 28, 1994-1999 |
2107431 | CIF | F H10 N2 O4 P | P 1 21/c 1 | 6.298; 8.311; 12.702 90; 98.58; 90 | 657.416 | Berndt, A. F.; Sylvester, J. M. The crystal structure of ammonium monofluorophosphate: (N H4)2 P O3 F (H2 O) Acta Crystallographica B (24,1968-38,1982), 1972, 28, 2191-2193 |
2107432 | CIF | F6 H12 Mg O6 Si | P 1 21/c 1 | 6.46; 9.524; 8.46 90; 99.24; 90 | 513.748 | Syoyama, S.; Osaki, K. An X-ray study of the low temperature form of Mg Si F6 (H2 O)6 and the relations between the crystal lattices of low-and high-temperature forms Acta Crystallographica B (24,1968-38,1982), 1972, 28, 2626-2627 |
2107433 | CIF | Cl2 O U | P b a m | 15.25; 17.8; 3.996 90; 90; 90 | 1084.71 | Taylor, J.C.; Wilson, P.W. The Structure of U O Cl2 by Neutron Diffraction Acta Crystallographica B (24,1968-38,1982), 1974, 30, 175-177 |
2107434 | CIF | Ba0.7 Cr1.4 O8 Sn1.6 | C 1 2/m 1 | 14.728; 3.108; 10.012 90; 134.27; 90 | 328.166 | Cadee, M.C.; Verschoor, G.C. Barium tin chromium oxide, a new hollandite phase Acta Crystallographica B (24,1968-38,1982), 1978, 34, 3554-3558 |
2107435 | CIF | Cs2 F4 H2 O3 U | P 1 21/c 1 | 8.06; 12.18; 9.29 90; 109.12; 90 | 861.696 | Dao, N. Q. Structure cristalline de Cs2 U O2 F4 H2 O Acta Crystallographica B (24,1968-38,1982), 1972, 28, 2011-2015 |
2107436 | CIF | H6 O5 P2 Zn | P 1 21/c 1 | 7.692; 7.391; 10.49 90; 104.15; 90 | 578.278 | Weakley, T.J.R. The crystal structures of manganese(II) phosphinate monohydrate, zinc phosphinate monohydrate, and anhydrous zinc phosphinate Acta Crystallographica B (24,1968-38,1982), 1979, 35, 42-45 |
2107437 | CIF | Ca Cl4 Cs2 H4 O2 | P -1 | 6.9038; 7.5127; 5.8774 92.28; 96.19; 65.23 | 275.174 | Evans, Jr., H. T.; Konnert, J. A.; Chou, I. M.; Romankiw, L. A. A Crystal Chemical Study of the System CsCl-NaCl-H~2~O; Structures of the CsCl Derivative Compounds Cs~1-x~(NaH~2~O)~x~Cl, CsNa~2~Cl~3~(H~2~O)~2~, and Cs~2~CaCl~4~(H~2~O)~2~ Acta Crystallographica, Section B: Structural Science, 1984, 40, 86-92 |
2107438 | CIF | O7 V4 | P -1 | 5.504; 7.007; 19.243 41.3; 72.5; 109.4 | 216.076 | Horiuchi, H.; Morimoto, N.; Tokonami, M.; Nagasawa, K. The crystal structure of V4 O7 Acta Crystallographica B (24,1968-38,1982), 1972, 28, 1404-1410 |
2107439 | CIF | Cl Mn2 O4 P | P n a 21 | 11.364; 8.0965; 4.9053 90; 90; 90 | 451.33 | Rea, J.R.; Kostiner, E. The crystal structure of manganese chlorophosphate, Mn2 (P O4) Cl Acta Crystallographica B (24,1968-38,1982), 1972, 28, 2505-2509 |
2107440 | CIF HKL Paper | C21 H24 F N3 O8 | P -1 | 9.579; 9.806; 11.612 78.66; 89.44; 78.85 | 1048.8 | Zhang, Guoshun; Zhang, Li; Yang, Dezhi; Zhang, Na; He, Lan; Du, Guanhua; Lu, Yang Salt screening and characterization of ciprofloxacin Acta Crystallographica Section B, 2016, 72, 20-28 |
2107441 | CIF HKL | C38 H46 F2 N6 O13 | P 1 21/n 1 | 9.922; 30.199; 13.528 90; 109.717; 90 | 3816 | Zhang, Guoshun; Zhang, Li; Yang, Dezhi; Zhang, Na; He, Lan; Du, Guanhua; Lu, Yang Salt screening and characterization of ciprofloxacin Acta Crystallographica Section B, 2016, 72, 20-28 |
2107442 | CIF HKL | C21 H22 F N3 O7 | P 1 21/c 1 | 13.956; 10.459; 15.184 90; 108.765; 90 | 2098.5 | Zhang, Guoshun; Zhang, Li; Yang, Dezhi; Zhang, Na; He, Lan; Du, Guanhua; Lu, Yang Salt screening and characterization of ciprofloxacin Acta Crystallographica Section B, 2016, 72, 20-28 |
2107443 | CIF HKL | C44 H58 F2 N6 O17 | P -1 | 10.225; 13.835; 18.56 72.83; 86.82; 68.03 | 2321.9 | Zhang, Guoshun; Zhang, Li; Yang, Dezhi; Zhang, Na; He, Lan; Du, Guanhua; Lu, Yang Salt screening and characterization of ciprofloxacin Acta Crystallographica Section B, 2016, 72, 20-28 |
2107444 | CIF HKL Paper | C24 H34 O2 S2 | P -1 | 5.047; 6.979; 16.333 98.79; 93.52; 95.39 | 564.3 | Ahmed, Maqsood; Nassour, Ayoub; Noureen, Sajida; Lecomte, Claude; Jelsch, Christian Experimental and theoretical charge-density analysis of 1,4-bis(5-hexyl-2-thienyl)butane-1,4-dione: applications of a virtual-atom model Acta Crystallographica Section B, 2016, 72, 75-86 |
2107445 | CIF HKL Paper | Eu0.04 O1.98 Zr0.96 | P 42/n m c | 3.6047; 3.6047; 5.184 90; 90; 90 | 67.36 | Marin, Riccardo; Sponchia, Gabriele; Back, Michele; Riello, Pietro Determining europium compositional fluctuations in partially stabilized zirconia nanopowders: a non-line-broadening-based method Acta Crystallographica Section B, 2016, 72 |
2107446 | CIF HKL Paper | Eu0.04 O1.98 Zr0.96 | P 42/n m c | 3.6053; 3.6053; 5.1843 90; 90; 90 | 67.387 | Marin, Riccardo; Sponchia, Gabriele; Back, Michele; Riello, Pietro Determining europium compositional fluctuations in partially stabilized zirconia nanopowders: a non-line-broadening-based method Acta Crystallographica Section B, 2016, 72 |
2107447 | CIF HKL Paper | Eu0.04 O1.98 Zr0.96 | P 1 21/c 1 | 5.164; 5.206; 5.325 90; 98.7; 90 | 141.51 | Marin, Riccardo; Sponchia, Gabriele; Back, Michele; Riello, Pietro Determining europium compositional fluctuations in partially stabilized zirconia nanopowders: a non-line-broadening-based method Acta Crystallographica Section B, 2016, 72 |
2107448 | CIF HKL Paper | Eu0.04 O1.98 Zr0.96 | P 42/n m c | 3.6055; 3.6055; 5.1841 90; 90; 90 | 67.391 | Marin, Riccardo; Sponchia, Gabriele; Back, Michele; Riello, Pietro Determining europium compositional fluctuations in partially stabilized zirconia nanopowders: a non-line-broadening-based method Acta Crystallographica Section B, 2016, 72 |
2107449 | CIF HKL Paper | Eu0.04 O1.98 Zr0.96 | P 1 21/c 1 | 5.1623; 5.2052; 5.3229 90; 98.63; 90 | 141.41 | Marin, Riccardo; Sponchia, Gabriele; Back, Michele; Riello, Pietro Determining europium compositional fluctuations in partially stabilized zirconia nanopowders: a non-line-broadening-based method Acta Crystallographica Section B, 2016, 72 |
2107450 | CIF HKL Paper | Eu0.04 O1.98 Zr0.96 | P 42/n m c | 3.6059; 3.6059; 5.1838 90; 90; 90 | 67.402 | Marin, Riccardo; Sponchia, Gabriele; Back, Michele; Riello, Pietro Determining europium compositional fluctuations in partially stabilized zirconia nanopowders: a non-line-broadening-based method Acta Crystallographica Section B, 2016, 72 |
2107451 | CIF HKL Paper | Eu0.04 O1.98 Zr0.96 | P 1 21/c 1 | 5.1595; 5.2069; 5.3223 90; 98.78; 90 | 141.31 | Marin, Riccardo; Sponchia, Gabriele; Back, Michele; Riello, Pietro Determining europium compositional fluctuations in partially stabilized zirconia nanopowders: a non-line-broadening-based method Acta Crystallographica Section B, 2016, 72 |
2107452 | CIF HKL Paper | Eu0.04 O1.98 Zr0.96 | P 42/n m c | 3.6062; 3.6062; 5.1841 90; 90; 90 | 67.418 | Marin, Riccardo; Sponchia, Gabriele; Back, Michele; Riello, Pietro Determining europium compositional fluctuations in partially stabilized zirconia nanopowders: a non-line-broadening-based method Acta Crystallographica Section B, 2016, 72 |
2107453 | CIF HKL Paper | Eu0.04 O1.98 Zr0.96 | P 1 21/c 1 | 5.1604; 5.2072; 5.3208 90; 98.822; 90 | 141.28 | Marin, Riccardo; Sponchia, Gabriele; Back, Michele; Riello, Pietro Determining europium compositional fluctuations in partially stabilized zirconia nanopowders: a non-line-broadening-based method Acta Crystallographica Section B, 2016, 72 |
2107454 | CIF HKL Paper | Eu0.04 O1.98 Zr0.96 | P 42/n m c | 3.612; 3.612; 5.172 90; 90; 90 | 67.48 | Marin, Riccardo; Sponchia, Gabriele; Back, Michele; Riello, Pietro Determining europium compositional fluctuations in partially stabilized zirconia nanopowders: a non-line-broadening-based method Acta Crystallographica Section B, 2016, 72 |
2107455 | CIF HKL Paper | Eu0.04 O1.98 Zr0.96 | P 1 21/c 1 | 5.1603; 5.2086; 5.3211 90; 98.912; 90 | 141.29 | Marin, Riccardo; Sponchia, Gabriele; Back, Michele; Riello, Pietro Determining europium compositional fluctuations in partially stabilized zirconia nanopowders: a non-line-broadening-based method Acta Crystallographica Section B, 2016, 72 |
2107456 | CIF HKL Paper | C15 H16 N2 O3 | P 1 21/c 1 | 10.116; 28.856; 4.8378 90; 103.908; 90 | 1370.8 | Sovago, Ioana; Gutmann, Matthias J.; Senn, Hans Martin; Thomas, Lynne H.; Wilson, Chick C.; Farrugia, Louis J. Electron density, disorder and polymorphism: high-resolution diffraction studies of the highly polymorphic neuralgic drug carbamazepine Acta Crystallographica Section B, 2016, 72, 39-50 |
2107457 | CIF HKL Paper | C15 H16 N2 O3 | P 1 21/c 1 | 10.144; 28.891; 4.847 90; 103.763; 90 | 1379.7 | Sovago, Ioana; Gutmann, Matthias J.; Senn, Hans Martin; Thomas, Lynne H.; Wilson, Chick C.; Farrugia, Louis J. Electron density, disorder and polymorphism: high-resolution diffraction studies of the highly polymorphic neuralgic drug carbamazepine Acta Crystallographica Section B, 2016, 72, 39-50 |
2107458 | CIF Paper | C15 H16 N2 O3 | C m c e | 19.638; 4.8378; 28.856 90; 90; 90 | 2741.5 | Sovago, Ioana; Gutmann, Matthias J.; Senn, Hans Martin; Thomas, Lynne H.; Wilson, Chick C.; Farrugia, Louis J. Electron density, disorder and polymorphism: high-resolution diffraction studies of the highly polymorphic neuralgic drug carbamazepine Acta Crystallographica Section B, 2016, 72, 39-50 |
2107459 | CIF Paper | C15 H16 N2 O3 | C m c e | 19.705; 4.847; 28.891 90; 90; 90 | 2759.4 | Sovago, Ioana; Gutmann, Matthias J.; Senn, Hans Martin; Thomas, Lynne H.; Wilson, Chick C.; Farrugia, Louis J. Electron density, disorder and polymorphism: high-resolution diffraction studies of the highly polymorphic neuralgic drug carbamazepine Acta Crystallographica Section B, 2016, 72, 39-50 |
2107460 | CIF HKL Paper | C15 H12 N2 O | P 1 21/n 1 | 7.498; 11.058; 13.789 90; 92.838; 90 | 1141.9 | Sovago, Ioana; Gutmann, Matthias J.; Senn, Hans Martin; Thomas, Lynne H.; Wilson, Chick C.; Farrugia, Louis J. Electron density, disorder and polymorphism: high-resolution diffraction studies of the highly polymorphic neuralgic drug carbamazepine Acta Crystallographica Section B, 2016, 72, 39-50 |
2107461 | CIF HKL Paper | C9 H7 N O4 | C 1 2/c 1 | 12.76; 8.0593; 16.6668 90; 104.61; 90 | 1658.53 | Wang, Ai; Ashurov, Jamshid; Ibragimov, Aziz; Wang, Ruimin; Mouhib, Halima; Mukhamedov, Nasir; Englert, Ulli Charge density of the biologically active molecule (2-oxo-1,3-benzoxazol-3(2<i>H</i>)-yl)acetic acid Acta Crystallographica Section B, 2016, 72, 142-150 |
2107462 | CIF HKL Paper | Ca2 H4 O9 P2 | P 1 21/n 1 | 12.60842; 9.24278; 6.74885 90; 104.992; 90 | 759.721 | Gras, Pierre; Rey, Christian; André, Gilles; Charvillat, Cédric; Sarda, Stéphanie; Combes, Christèle Crystal structure of monoclinic calcium pyrophosphate dihydrate (m-CPPD) involved in inflammatory reactions and osteoarthritis Acta Crystallographica Section B, 2016, 72, 96-101 |
2107463 | CIF Paper | Ca2 H4 O9 P2 | P 1 21/n 1 | 12.584; 9.2184; 6.7372 90; 104.949; 90 | 755.09 | Gras, Pierre; Rey, Christian; André, Gilles; Charvillat, Cédric; Sarda, Stéphanie; Combes, Christèle Crystal structure of monoclinic calcium pyrophosphate dihydrate (m-CPPD) involved in inflammatory reactions and osteoarthritis Acta Crystallographica Section B, 2016, 72, 96-101 |
2107464 | CIF Paper | C5 H14 N O6 P | P 1 21/a 1 | 11.91; 19.682; 25.516 90; 93.74; 90 | 5969 | Ślepokura, Katarzyna Anna Reversible <i>chair</i> {łeftrightarrow} <i>skew</i> conformational interconversion of 1,3,2-dioxaphosphorinane ring in the solid state Acta Crystallographica Section B, 2016, 72, 117-125 |
2107465 | CIF | C5 H14 N O6 P | P -1 | 11.873; 19.569; 14.218 116.88; 93.62; 90.15 | 2938.8 | Ślepokura, Katarzyna Anna Reversible <i>chair</i> {łeftrightarrow} <i>skew</i> conformational interconversion of 1,3,2-dioxaphosphorinane ring in the solid state Acta Crystallographica Section B, 2016, 72, 117-125 |
2107466 | CIF | C5 H14 N O6 P | P 1 21/a 1 | 11.39; 6.862; 12.216 90; 97.86; 90 | 945.8 | Ślepokura, Katarzyna Anna Reversible <i>chair</i> {łeftrightarrow} <i>skew</i> conformational interconversion of 1,3,2-dioxaphosphorinane ring in the solid state Acta Crystallographica Section B, 2016, 72, 117-125 |
2107467 | CIF | C5 H14 N O6 P | P -1 | 11.336; 20.486; 25.369 105.6; 97.5; 90.17 | 5621 | Ślepokura, Katarzyna Anna Reversible <i>chair</i> {łeftrightarrow} <i>skew</i> conformational interconversion of 1,3,2-dioxaphosphorinane ring in the solid state Acta Crystallographica Section B, 2016, 72, 117-125 |
2107468 | CIF HKL Paper | Ca2 Co O7 Si2 | P 21 21 2 | 23.52; 23.52; 5.03 90; 90; 90 | 2783 | Sazonov, Andrew; Hutanu, Vladimir; Meven, Martin; Roth, Georg; Kézsmárki, István; Murakawa, Hiroshi; Tokura, Yoshinori; Náfrádi, Bálint The low-temperature crystal structure of the multiferroic melilite Ca~2~CoSi~2~O~7~ Acta Crystallographica Section B, 2016, 72, 126-132 |
2107469 | CIF Paper | C38 H42 Cu N6 O11 | F d d 2 | 27; 56.855; 10.756 90; 90; 90 | 16511 | Pradhan, Subhashis; Moon, Dohyun; John, Rohith P. A double stranded metal‒organic assembly accommodating a pair of water trimers in the host cavity and catalysing Glaser coupling Acta Crystallographica Section B, 2016, 72, 102-108 |
2107470 | CIF Paper | Cs3 O15 Sc Si6 | R -3 m :H | 13.8611; 13.8611; 6.9924 90; 90; 120 | 1163.5 | Hejny, Clivia; Kahlenberg, Volker; Schmidmair, Daniela; Dabić, Predrag (3+1)-Incommensurately modulated crystal structure of Cs~3~ScSi~6~O~15~ Acta Crystallographica Section B, 2016, 72, 109-116 |
2107471 | CIF HKL Paper | C28 H24 N2 O4 | P 1 21/n 1 | 7.7952; 7.1669; 20.7708 90; 93.2075; 90 | 1158.59 | Lorenzo, Daniel A.; Forrest, Sebastian J. K.; Sparkes, Hazel A. Crystal engineering: co-crystals of cinnamic acid derivatives with a pyridyl derivative co-crystallizer Acta Crystallographica Section B, 2016, 72, 87-95 |
2107472 | CIF HKL | C15 H14 N2 O3 | P -1 | 8.4176; 10.6487; 15.0679 75.883; 82.329; 83.301 | 1293.14 | Lorenzo, Daniel A.; Forrest, Sebastian J. K.; Sparkes, Hazel A. Crystal engineering: co-crystals of cinnamic acid derivatives with a pyridyl derivative co-crystallizer Acta Crystallographica Section B, 2016, 72, 87-95 |
2107473 | CIF HKL | C15 H14 N2 O3 | P 1 21/c 1 | 14.0191; 6.1871; 16.6387 90; 111.74; 90 | 1340.55 | Lorenzo, Daniel A.; Forrest, Sebastian J. K.; Sparkes, Hazel A. Crystal engineering: co-crystals of cinnamic acid derivatives with a pyridyl derivative co-crystallizer Acta Crystallographica Section B, 2016, 72, 87-95 |
2107474 | CIF HKL | C30 H28 N2 O4 | P -1 | 10.8843; 15.651; 16.6073 63.358; 79.726; 77.722 | 2459.66 | Lorenzo, Daniel A.; Forrest, Sebastian J. K.; Sparkes, Hazel A. Crystal engineering: co-crystals of cinnamic acid derivatives with a pyridyl derivative co-crystallizer Acta Crystallographica Section B, 2016, 72, 87-95 |
2107475 | CIF HKL | C16 H16 N2 O3 | P -1 | 7.0311; 8.6172; 11.949 77.4101; 87.9565; 82.6358 | 700.71 | Lorenzo, Daniel A.; Forrest, Sebastian J. K.; Sparkes, Hazel A. Crystal engineering: co-crystals of cinnamic acid derivatives with a pyridyl derivative co-crystallizer Acta Crystallographica Section B, 2016, 72, 87-95 |
2107476 | CIF HKL | C30 H28 N2 O6 | P 1 21/n 1 | 6.4681; 28.9773; 6.893 90; 103.812; 90 | 1254.58 | Lorenzo, Daniel A.; Forrest, Sebastian J. K.; Sparkes, Hazel A. Crystal engineering: co-crystals of cinnamic acid derivatives with a pyridyl derivative co-crystallizer Acta Crystallographica Section B, 2016, 72, 87-95 |
2107477 | CIF HKL | C16 H16 N2 O4 | P -1 | 9.1225; 11.5523; 14.1938 90.7; 90.577; 104.055 | 1450.81 | Lorenzo, Daniel A.; Forrest, Sebastian J. K.; Sparkes, Hazel A. Crystal engineering: co-crystals of cinnamic acid derivatives with a pyridyl derivative co-crystallizer Acta Crystallographica Section B, 2016, 72, 87-95 |
2107478 | CIF HKL | C17 H18 N2 O5 | P 1 21/c 1 | 14.02; 9.8795; 11.6434 90; 96.975; 90 | 1600.8 | Lorenzo, Daniel A.; Forrest, Sebastian J. K.; Sparkes, Hazel A. Crystal engineering: co-crystals of cinnamic acid derivatives with a pyridyl derivative co-crystallizer Acta Crystallographica Section B, 2016, 72, 87-95 |
2107479 | CIF HKL Paper | Cr Fe O3 | R -3 :H | 5.077; 5.077; 13.9621 90; 90; 120 | 311.67 | Pérez-Cruz, María Ana; Elizalde-González, María de la Paz; Escudero, Roberto; Bernès, Sylvain; Silva-González, Rutilo; Reyes-Ortega, Yasmi At last! The single-crystal X-ray structure of a naturally occurring sample of the ilmenite-type oxide FeCrO~3~ Acta Crystallographica Section B, 2015, 71, 555-561 |
2107480 | CIF Paper | C23 H41 Fe N3 O2 P2 | P 1 1 21/b | 31.781; 18.012; 18.262 90; 90; 90.004 | 10454 | Bichler, Bernhard; Holzhacker, Christian; Glatz, Mathias; Stöger, Berthold; Kirchner, Karl Twinning of three Fe-PNP pincer complexes interpreted according to order‒disorder (OD) theory Acta Crystallographica Section B, 2015, 71, 524-534 |
2107481 | CIF Paper | C14 H25 Br2 Fe N3 O P2 | P 1 21/n 1 | 9.2939; 11.7224; 18.307 90; 94.999; 90 | 1986.9 | Bichler, Bernhard; Holzhacker, Christian; Glatz, Mathias; Stöger, Berthold; Kirchner, Karl Twinning of three Fe-PNP pincer complexes interpreted according to order‒disorder (OD) theory Acta Crystallographica Section B, 2015, 71, 524-534 |
2107482 | CIF Paper | C46 H55 Cl2 Fe N3 O5 P2 | P 1 | 9.3389; 10.3155; 24.3224 96.277; 92.393; 90.009 | 2327 | Bichler, Bernhard; Holzhacker, Christian; Glatz, Mathias; Stöger, Berthold; Kirchner, Karl Twinning of three Fe-PNP pincer complexes interpreted according to order‒disorder (OD) theory Acta Crystallographica Section B, 2015, 71, 524-534 |
2107483 | CIF HKL Paper | C46.111 H40.444 F12 N8 O1.333 P2 Ru | P 1 | 18.3127; 21.3286; 29.264 81.874; 89.211; 69.108 | 10563.1 | Wachter, Erin; Glazer, Edith C.; Parkin, Sean; Brock, Carolyn Pratt An exceptional 5:4 enantiomeric structure Acta Crystallographica Section B, 2016, 72, 223-231 |
2107484 | CIF HKL Paper | C6 H6 N4 O4 | P 1 21 1 | 4.1964; 7.0129; 14.4528 90; 90.924; 90 | 425.28 | Pogoda, Dorota; Janczak, Jan; Videnova-Adrabinska, Veneta New polymorphs of an old drug: conformational and synthon polymorphism of 5-nitrofurazone Acta Crystallographica Section B, 2016, 72, 263-273 |
2107485 | CIF HKL | C6 H6 N4 O4 | P 1 21/c 1 | 13.5703; 7.8254; 7.9677 90; 102.26; 90 | 826.82 | Pogoda, Dorota; Janczak, Jan; Videnova-Adrabinska, Veneta New polymorphs of an old drug: conformational and synthon polymorphism of 5-nitrofurazone Acta Crystallographica Section B, 2016, 72, 263-273 |
2107486 | CIF Paper | F K2 O6 Sc Si2 | P 42/m n m | 8.978; 8.978; 8.2608 90; 90; 90 | 665.86 | Hejny, Clivia; Kahlenberg, Volker; Eberhard, Tim; Krüger, Hannes Melilite-like modulation and temperature-dependent evolution in the framework structure of K~2~Sc[Si~2~O~6~]F Acta Crystallographica Section B, 2016, 72, 209-222 |
2107487 | CIF Paper | F K2 O6 Sc Si2 | P 42/m n m | 8.9878; 8.9878; 8.2694 90; 90; 90 | 668.007 | Hejny, Clivia; Kahlenberg, Volker; Eberhard, Tim; Krüger, Hannes Melilite-like modulation and temperature-dependent evolution in the framework structure of K~2~Sc[Si~2~O~6~]F Acta Crystallographica Section B, 2016, 72, 209-222 |
2107488 | CIF Paper | F K2 O6 Sc Si2 | P 42/m n m | 8.9939; 8.9939; 8.2758 90; 90; 90 | 669.43 | Hejny, Clivia; Kahlenberg, Volker; Eberhard, Tim; Krüger, Hannes Melilite-like modulation and temperature-dependent evolution in the framework structure of K~2~Sc[Si~2~O~6~]F Acta Crystallographica Section B, 2016, 72, 209-222 |
2107489 | CIF Paper | F K2 O6 Sc Si2 | P 42/m n m | 8.9878; 8.9878; 8.2694 90; 90; 90 | 668.007 | Hejny, Clivia; Kahlenberg, Volker; Eberhard, Tim; Krüger, Hannes Melilite-like modulation and temperature-dependent evolution in the framework structure of K~2~Sc[Si~2~O~6~]F Acta Crystallographica Section B, 2016, 72, 209-222 |
2107490 | CIF Paper | F K2 O6 Sc Si2 | P 42/m n m | 8.9705; 8.9705; 8.2615 90; 90; 90 | 664.8 | Hejny, Clivia; Kahlenberg, Volker; Eberhard, Tim; Krüger, Hannes Melilite-like modulation and temperature-dependent evolution in the framework structure of K~2~Sc[Si~2~O~6~]F Acta Crystallographica Section B, 2016, 72, 209-222 |
2107491 | CIF Paper | F K2 O6 Sc Si2 | P 42/m n m | 8.9622; 8.9622; 8.2705 90; 90; 90 | 664.3 | Hejny, Clivia; Kahlenberg, Volker; Eberhard, Tim; Krüger, Hannes Melilite-like modulation and temperature-dependent evolution in the framework structure of K~2~Sc[Si~2~O~6~]F Acta Crystallographica Section B, 2016, 72, 209-222 |
2107492 | CIF HKL Paper | C24 H29 N3 O7 | P 1 21/c 1 | 12.2625; 14.1634; 15.425 90; 113.843; 90 | 2450.4 | Cvetkovski, Aleksandar; Bertolasi, Valerio; Ferretti, Valeria Supramolecular hydrogen-bonding patterns of co-crystals containing the active pharmaceutical ingredient (API) phloroglucinol and <i>N</i>-heterocycles Acta Crystallographica Section B, 2016, 72, 326-334 |
2107493 | CIF HKL | C24 H30 N6 O6 | P -1 | 7.7212; 12.4488; 14.2673 112.608; 95.561; 93.541 | 1252.69 | Cvetkovski, Aleksandar; Bertolasi, Valerio; Ferretti, Valeria Supramolecular hydrogen-bonding patterns of co-crystals containing the active pharmaceutical ingredient (API) phloroglucinol and <i>N</i>-heterocycles Acta Crystallographica Section B, 2016, 72, 326-334 |
2107494 | CIF HKL | C28 H24 N2 O3 | P 1 21/c 1 | 18.4503; 7.3939; 18.7699 90; 114.924; 90 | 2322.11 | Cvetkovski, Aleksandar; Bertolasi, Valerio; Ferretti, Valeria Supramolecular hydrogen-bonding patterns of co-crystals containing the active pharmaceutical ingredient (API) phloroglucinol and <i>N</i>-heterocycles Acta Crystallographica Section B, 2016, 72, 326-334 |
2107495 | CIF HKL | C16 H16 N2 O5 | P 1 21/c 1 | 7.7275; 19.8281; 11.308 90; 117.679; 90 | 1534.35 | Cvetkovski, Aleksandar; Bertolasi, Valerio; Ferretti, Valeria Supramolecular hydrogen-bonding patterns of co-crystals containing the active pharmaceutical ingredient (API) phloroglucinol and <i>N</i>-heterocycles Acta Crystallographica Section B, 2016, 72, 326-334 |
2107496 | CIF HKL | C36 H48 N6 O6 | P 1 21/c 1 | 15.6225; 13.501; 17.2314 90; 90.235; 90 | 3634.41 | Cvetkovski, Aleksandar; Bertolasi, Valerio; Ferretti, Valeria Supramolecular hydrogen-bonding patterns of co-crystals containing the active pharmaceutical ingredient (API) phloroglucinol and <i>N</i>-heterocycles Acta Crystallographica Section B, 2016, 72, 326-334 |
2107497 | CIF HKL | C32 H27 Ag2 F12 N10 O6 P5 | P -1 | 12.6372; 12.985; 14.7076 77.68; 68.355; 87.319 | 2190.24 | Davarcı, Derya; Gür, Rüştü; Beşli, Serap; Şenkuytu, Elif; Zorlu, Yunus Silver(I) coordination polymers assembled from flexible cyclotriphosphazene ligand: structures, topologies and investigation of the counteranion effects Acta Crystallographica Section B, 2016, 72, 344-356 |
2107498 | CIF HKL | C32 H27 Ag2 Cl2 N10 O14 P3 | P -1 | 12.7463; 12.7843; 14.4175 69.521; 77.152; 87.168 | 2144.75 | Davarcı, Derya; Gür, Rüştü; Beşli, Serap; Şenkuytu, Elif; Zorlu, Yunus Silver(I) coordination polymers assembled from flexible cyclotriphosphazene ligand: structures, topologies and investigation of the counteranion effects Acta Crystallographica Section B, 2016, 72, 344-356 |
2107499 | CIF HKL | C51 H45 Ag3 N9 O15 P3 S3 | P -1 | 13.1577; 13.7793; 18.4731 93.043; 104.723; 112.509 | 2949.8 | Davarcı, Derya; Gür, Rüştü; Beşli, Serap; Şenkuytu, Elif; Zorlu, Yunus Silver(I) coordination polymers assembled from flexible cyclotriphosphazene ligand: structures, topologies and investigation of the counteranion effects Acta Crystallographica Section B, 2016, 72, 344-356 |
2107500 | CIF HKL | C32 H27 Ag2 B2 F8 N10 O6 P3 | P 1 | 8.1432; 9.879; 13.567 99.386; 99.515; 103.137 | 1025.1 | Davarcı, Derya; Gür, Rüştü; Beşli, Serap; Şenkuytu, Elif; Zorlu, Yunus Silver(I) coordination polymers assembled from flexible cyclotriphosphazene ligand: structures, topologies and investigation of the counteranion effects Acta Crystallographica Section B, 2016, 72, 344-356 |
2107501 | CIF HKL | C30 H24 N9 O6 P3 | P 1 21/c 1 | 17.9886; 22.4886; 7.5366 90; 90.522; 90 | 3048.72 | Davarcı, Derya; Gür, Rüştü; Beşli, Serap; Şenkuytu, Elif; Zorlu, Yunus Silver(I) coordination polymers assembled from flexible cyclotriphosphazene ligand: structures, topologies and investigation of the counteranion effects Acta Crystallographica Section B, 2016, 72, 344-356 |
2107502 | CIF HKL | C30 H26 Ag2 N11 O13 P3 | P 1 21 1 | 8.2988; 23.5144; 9.673 90; 101.61; 90 | 1848.98 | Davarcı, Derya; Gür, Rüştü; Beşli, Serap; Şenkuytu, Elif; Zorlu, Yunus Silver(I) coordination polymers assembled from flexible cyclotriphosphazene ligand: structures, topologies and investigation of the counteranion effects Acta Crystallographica Section B, 2016, 72, 344-356 |
2107503 | CIF HKL | C31 H24 Ag F3 N9 O9 P3 S | R -3 | 12.5705; 12.5705; 38.213 90; 90; 120 | 5229.3 | Davarcı, Derya; Gür, Rüştü; Beşli, Serap; Şenkuytu, Elif; Zorlu, Yunus Silver(I) coordination polymers assembled from flexible cyclotriphosphazene ligand: structures, topologies and investigation of the counteranion effects Acta Crystallographica Section B, 2016, 72, 344-356 |
2107504 | CIF Paper | C18 H20 N2 O3 | P -1 | 8.476; 9.923; 20.882 92.5; 93.048; 106.171 | 1681.3 | Prasad, A. Aditya; Kumar, C. Udhaya; Prakasam, B. Arul; Meenakshisundaram, S. P. Conformational polymorphs of isobutyl-6-amino-5-cyano-2-methyl-4-phenyl-4<i>H</i>-pyran-3-carboxylate: spectroscopic, structural and DFT approach Acta Crystallographica Section B, 2016, 72, 301-309 |
2107505 | CIF HKL Paper | C19 H21 N5 O3 S | P -1 | 9.2198; 9.7844; 11.7345 94.456; 103.358; 95.444 | 1019.85 | Sharma, Sakshi; Brahmachari, Goutam; Kant, Rajni; Gupta, Vivek K. One-pot green synthesis of biologically relevant novel spiro[indolin-2-one-3,4'-pyrano[2,3-<i>c</i>]pyrazoles] and studies on their spectral and X-ray crystallographic behaviors Acta Crystallographica Section B, 2016, 72, 335-343 |
2107506 | CIF HKL | C19 H20 F N5 O3 S | P -1 | 9.139; 9.877; 12.166 91.214; 102.681; 95.862 | 1064.7 | Sharma, Sakshi; Brahmachari, Goutam; Kant, Rajni; Gupta, Vivek K. One-pot green synthesis of biologically relevant novel spiro[indolin-2-one-3,4'-pyrano[2,3-<i>c</i>]pyrazoles] and studies on their spectral and X-ray crystallographic behaviors Acta Crystallographica Section B, 2016, 72, 335-343 |
2107507 | CIF HKL | C68 H52 N20 O17 | C 1 2/c 1 | 7.6155; 27.2024; 16.0187 90; 98.988; 90 | 3277.7 | Sharma, Sakshi; Brahmachari, Goutam; Kant, Rajni; Gupta, Vivek K. One-pot green synthesis of biologically relevant novel spiro[indolin-2-one-3,4'-pyrano[2,3-<i>c</i>]pyrazoles] and studies on their spectral and X-ray crystallographic behaviors Acta Crystallographica Section B, 2016, 72, 335-343 |
2107508 | CIF HKL Paper | Se Sn0.9816 | P n m a | 11.4422; 4.13054; 4.449 90; 90; 90 | 210.271 | Sist, Mattia; Zhang, Jiawei; Brummerstedt Iversen, Bo Crystal structure and phase transition of thermoelectric SnSe Acta Crystallographica Section B, 2016, 72, 310-316 |
2107509 | CIF HKL Paper | Se Sn0.9816 | P n m a | 11.46438; 4.13865; 4.44651 90; 90; 90 | 210.974 | Sist, Mattia; Zhang, Jiawei; Brummerstedt Iversen, Bo Crystal structure and phase transition of thermoelectric SnSe Acta Crystallographica Section B, 2016, 72, 310-316 |
2107510 | CIF HKL Paper | Se Sn0.9816 | P n m a | 11.48933; 4.14894; 4.44118 90; 90; 90 | 211.705 | Sist, Mattia; Zhang, Jiawei; Brummerstedt Iversen, Bo Crystal structure and phase transition of thermoelectric SnSe Acta Crystallographica Section B, 2016, 72, 310-316 |
2107511 | CIF HKL Paper | Se Sn0.9816 | P n m a | 11.49417; 4.15096; 4.44175 90; 90; 90 | 211.924 | Sist, Mattia; Zhang, Jiawei; Brummerstedt Iversen, Bo Crystal structure and phase transition of thermoelectric SnSe Acta Crystallographica Section B, 2016, 72, 310-316 |
2107512 | CIF HKL Paper | Se Sn0.9816 | P n m a | 11.51746; 4.16192; 4.43267 90; 90; 90 | 212.479 | Sist, Mattia; Zhang, Jiawei; Brummerstedt Iversen, Bo Crystal structure and phase transition of thermoelectric SnSe Acta Crystallographica Section B, 2016, 72, 310-316 |
2107513 | CIF HKL Paper | Se Sn0.9816 | P n m a | 11.51965; 4.16265; 4.43427 90; 90; 90 | 212.633 | Sist, Mattia; Zhang, Jiawei; Brummerstedt Iversen, Bo Crystal structure and phase transition of thermoelectric SnSe Acta Crystallographica Section B, 2016, 72, 310-316 |
2107514 | CIF HKL Paper | Se Sn0.9816 | P n m a | 11.54547; 4.17619; 4.42402 90; 90; 90 | 213.309 | Sist, Mattia; Zhang, Jiawei; Brummerstedt Iversen, Bo Crystal structure and phase transition of thermoelectric SnSe Acta Crystallographica Section B, 2016, 72, 310-316 |
2107515 | CIF HKL Paper | Se Sn0.9816 | P n m a | 11.57949; 4.19611; 4.40769 90; 90; 90 | 214.164 | Sist, Mattia; Zhang, Jiawei; Brummerstedt Iversen, Bo Crystal structure and phase transition of thermoelectric SnSe Acta Crystallographica Section B, 2016, 72, 310-316 |
2107516 | CIF HKL Paper | Se Sn0.9816 | P n m a | 11.62; 4.22357; 4.38333 90; 90; 90 | 215.125 | Sist, Mattia; Zhang, Jiawei; Brummerstedt Iversen, Bo Crystal structure and phase transition of thermoelectric SnSe Acta Crystallographica Section B, 2016, 72, 310-316 |
2107517 | CIF HKL Paper | Se Sn0.9816 | P n m a | 11.64398; 4.24224; 4.36522 90; 90; 90 | 215.627 | Sist, Mattia; Zhang, Jiawei; Brummerstedt Iversen, Bo Crystal structure and phase transition of thermoelectric SnSe Acta Crystallographica Section B, 2016, 72, 310-316 |
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