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  • Articles  (18)
  • Crystal structure  (10)
  • chironomids  (8)
  • Springer  (18)
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  • Articles  (18)
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  • Springer  (18)
  • American Meteorological Society
  • American Physical Society (APS)
  • Blackwell Publishing Ltd
  • International Union of Crystallography
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  • 1
    ISSN: 1572-8854
    Keywords: Crystal structure ; AM1 ; x-ray diffraction ; dihydropiridines
    Source: Springer Online Journal Archives 1860-2000
    Topics: Geosciences , Physics
    Notes: Abstract The synthesis and structural characterization of Methyl 6-chloro-4-(2-chlorophenyl)-5-formyl-2-methyl-1,4-dihydropyridine-3-carboxylate is described. The structure was refined to R1 = 0.0470 for 2665 reflections (with I 〉 2σ(I)). Crystal data: C15H13C12NO3, monoclinic,space group P21/c, a = 11.163(9), b = 14.484(8), c = 9.422(7) Å, V = 1512.9(19) Å3, Z = 4. The results of crystallographic and molecular modeling (AM1) were compared. The Cl atom attached to the phenyl group has two possible orientations, having 75% (sp) and 25% (ap) occupancy, respectively. The molecules in the crystal are held together by means of intermolecular hydrogen bonds of the type N=H...O and by C=H...O interactions.
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  • 2
    ISSN: 1572-8854
    Keywords: Crystal structure ; manganese(IV) cluster ; adamantane-shaped complex ; tetranuclear complex
    Source: Springer Online Journal Archives 1860-2000
    Topics: Geosciences , Physics
    Notes: Abstract A tetranuclear manganese (IV) complex, [L4Mn4O6](ClO4)4·2H2O (1), with 1,4,7-triazacyclononane (L) as the capping ligands, has been synthesized and characterized by X-ray diffraction; monoclinic, space group P21/n with a = 21.335(6) Å, b = 11.387(3) Å, c = 21.788 (6) Å, β = 111.410 (6)°, V = 4928 (2) Å, Z = 4. Each manganese atom has a distorted octahedral environment comprised of three facially coordinated amine nitrogen atoms and three oxygen atoms, and the cation is an idealized tetrahedron. The Mn4O6 4+ cation corresponds to an adamantane skeleton.
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  • 3
    ISSN: 1572-8854
    Keywords: Crystal structure ; hydrogen bonds ; 1H and 13C NMR ; FTIR
    Source: Springer Online Journal Archives 1860-2000
    Topics: Geosciences , Physics
    Notes: Abstract A new pyridine containing compound, 4,4′-bis(4-pyridylethyl)biphenyl 1, was synthesized and its structure was determined by X-ray crystallography. Two kinds of two-dimensional networks linked by hydrogen bonds were obtained with different crystal solvents: 1·2H2O, monoclinic, space group P21/n with a = 8.3280(10), b = 5.5990(10), c = 24.054(4) Å, β = 98.79(2)°, V = 1108.4(3) Å3, Z = 2, Dc = 1.200 g cm−3, R1 = 0.0558; 1·CH3OH·2H2O, triclinic, space group P-1 with a = 8.3310(10), b = 12.861(2), c = 13.111(2) Å, α = 64.110(10), β = 75.000(10), γ = 83.750(10)°, V = 1220.7(3) Å3, Z = 2, Dc = 1.177 g cm−3, R1 = 0.0529. It is interesting that in the hydrate the host molecule of 1 contains an essentially flat biphenyl section, while in the methanol complex the host molecule of 1 contains a substantial twist in the center of the biphenyl section. The compounds were also characterized by NMR and FTIR spectroscopies. The 1H and 13C NMR assignments for 1 were carried out by 2D NMR spectral measurements in acetonitrile-d 3.
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  • 4
    ISSN: 1572-8854
    Keywords: Crystal structure ; poly(pyrazolyl)borate ligands ; zinc(II)
    Source: Springer Online Journal Archives 1860-2000
    Topics: Geosciences , Physics
    Notes: Abstract [HB(3,4,5-Me3pz)3]2Zn (1) and [H2B(3,4,5-Me3pz)2]Zn(μ-3,4,5-Me3pz)2Zn[H2B(3,4,5-Me3pz)2] (2) are present in equal amounts in a crystal in the triclinic space group, P-1 with a = 11.5924(11) Å, b = 12.7799(12) Å, c = 15.7317(14) Å α = 107.905(2)° β = 96.796(2)°, γ = 105.786(2)°, and Z = 1. The structure of 1 is a trigonally distorted octahedron and is very similar to the structure of [HB(3,5-Me2pz)3]2Zn showing that the introduction of the third methyl group on the pyrazolyl ring does not impact on structure. [H2B(pz)2]2Zn (3) is orthorhombic, Pca2(1) with a = 10.1473(3) Å, b = 11.1117(2) Å, c = 14.1831(5) Å, α = β = γ = 90° and Z = 4. The zinc(II) centers in both 2 and 3 are similar and have pseudotetrahedral structures.
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  • 5
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    Journal of chemical crystallography 30 (2000), S. 335-338 
    ISSN: 1572-8854
    Keywords: Crystal structure ; cobalt(II) complex ; tetraaza macrocycle ; 2-pyridylmethyl pendant arms
    Source: Springer Online Journal Archives 1860-2000
    Topics: Geosciences , Physics
    Notes: Abstract The complex [Co(L)]Cl2·10H2O (1) (L = 2,13,-bis(2-pyridylmethyl)-3,14-dimethyl-2,6,13,17-tetraazatricyclo[14,4,01.18,07.12]docosane) has been synthesized and structurally characterized. Compound 1 crystallizes in the triclinic system, space group P-1 with a = 9.731(2) Å, b = 9.789(2) Å, c = 11.998(1) Å, α = 66.66(1)°, β = 76.95(1)°, γ = 87.99(2)°, V = 1020.4(3) Å3, and Z = 1. The crystal structure of 1 shows that the complex is centrosymmetric and the cobalt(II) ion has a slightly distorted octahedral geometry with four nitrogen atoms of the macrocycle and two nitrogen atoms of the pendent arms at the axial positions. Cyclic voltammetry for 1 undergoes reversible one-electron oxidation to the Co(III) and irreversible one-electron reduction to the Co(I).
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  • 6
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    Journal of chemical crystallography 30 (2000), S. 459-462 
    ISSN: 1572-8854
    Keywords: Crystal structure ; chemical synthesis ; 2,3-dihydronaphto[2,3-b] [1,5) dioxepin
    Source: Springer Online Journal Archives 1860-2000
    Topics: Geosciences , Physics
    Notes: Abstract The X-ray single crystal structure of C13H12O2 compound was determined. It crystallizes in the orthorombic space group P212121 with a = 7.8847(7), b = 9.639(1), c = 13.432(2) Å, Z = 4 and V = 1020.8(3) Å3. The final R converged to 0.037 for 1763 independent reflexions. The title compound forms layers parallel to (1 0 0) planes and the three dimensional cohesion of the crystal is assumed by Van der Waals interactions. The molecule consists of two six-membered rings (A and B) and a seven-membered ring (C). A and B rings are planar, whereas the C ring has a chair conformation
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  • 7
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    Journal of paleolimnology 23 (2000), S. 77-89 
    ISSN: 1573-0417
    Keywords: chironomids ; climate reconstruction ; calibration ; Weighted Averaging Partial Least Squares ; late-glacial ; Kråenes ; Younger Dryas ; Allerød
    Source: Springer Online Journal Archives 1860-2000
    Topics: Biology , Geosciences
    Notes: Abstract A chironomid data-set calibrated to July air temperatures, based on 44 lakes in western Norway, is used to reconstruct mean July air temperatures from late-glacial and early-Holocene fossil chironomid assemblages at Kråkenes Lake. The calibration function is based on Weighted Averaging Partial Least Squares regression and has a root mean square error of prediction (RMSEP) of 1.13 °C, a r2 of 0.69, and a maximum bias of 2.66 °C. All these statistics are based on leave-one-out cross-validation. A calibration function based on summer surface-water temperatures has a poorer performance (RMSEP = 2.22 °C, r2 = 0.30, maximum bias = 5.29 °C). The reconstructed July air temperatures at Kråkenes rise to 10.5 °C soon after deglaciation, are about 11.5 °C in the Allerød, decrease to 9.5-10 °C in the Younger Dryas, and rise rapidly within 15 yrs to 11.5 °C at the onset of the Holocene. There is a two-step rise to 13 °C or more in the early-Holocene. The likely over-estimation of Younger Dryas temperatures and under-estimation of early-Holocene temperatures probably result from the limited temperature range represented by the existing calibration set. The data set is currently being expanded to include lakes with warmer air temperatures (〉 14 °C) and with colder air temperatures (〈 8 °C).
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  • 8
    ISSN: 1573-0417
    Keywords: crater lake ; late Pleistocene ; pigments ; diatoms ; ostracods ; Cladocera ; chironomids ; climatic oscillation ; Italy
    Source: Springer Online Journal Archives 1860-2000
    Topics: Biology , Geosciences
    Notes: Abstract We report the results of analyses of pigments (derived from algae and photosynthetic bacteria), diatoms and invertebrate fossil remains (ostracods, cladocerans, chironomids) in two late Pleistocene sediment cores from Lago Albano, a crater lake in Central Italy. The record contains evidence for oscillations in lake biota throughout the period ca. 28 to 17 k yr BP. The earliest of these are contained in the basal 3.5 m of light olive-gray and yellowish-gray spotted muds sampled in core PALB 94-1E from 70 m water depth. The later oscillations are best represented in the more extended sediment sequence recovered from a second core site, PALB 94-6B, in 30 m water depth. The sediments at site 1E, containing the earlier oscillations (ca. 28-24 k yr BP), predate any sedimentation at the shallower site, from which we infer an initially low lake level rising to permit sediment accumulation at site 6B from ca. 24 k yr onwards. At site 6B, massive silts rich in moss remains are interbedded with laminated silts and carbonates. These sediments span the period ca. 24 to 17 k yr and are interpreted as representing, respectively, times of shallow water alternating with higher lake stands, when the lake was stratified and bottom water was stagnant. A range of mutually independent chronological constraints on the frequency and duration of the oscillations recorded in the lake biota indicate that they were aperiodic and occurred on millennial to century timescales. We interpret them as responses to climate forcing through its impact on lake levels and changing aquatic productivity. The time span they occupy, their frequency and their duration suggest that at least some of these changes may parallel both the Dansgaard-Oeschger events recorded in Greenland Ice Cores and the contemporary oscillations in North Atlantic circulation documented in marine sediment cores.
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  • 9
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    Journal of paleolimnology 23 (2000), S. 207-212 
    ISSN: 1573-0417
    Keywords: chironomids ; nutrient enrichment ; macrophytes ; paleolimnology ; shallow lakes ; Rideau Canal ; alternative lake equilibria ; Ontario
    Source: Springer Online Journal Archives 1860-2000
    Topics: Biology , Geosciences
    Notes: Abstract Chironomid (Diptera: Chironomidae) head capsules were studied from a core of recent sediments from shallow, macrophyte-dominated Lake Opinicon, Ontario, Canada, to determine if assemblages have changed in response to lake-level changes and other watershed disturbances, including deforestation and agriculture. Our results indicate that the construction of the Rideau Canal in the early 1830s and subsequent flooding of Lake Opinicon has had the greatest impact on this system, but that even this disturbance did not greatly affect chironomid assemblages. Despite other significant cultural disturbances in the watershed, the lake sediments have recorded only minor changes in its recent history, providing support for the hypothesis of alternative lake equilibria. These results correspond well with diatom inferences of only minor changes in past lake trophic status.
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  • 10
    ISSN: 1573-0417
    Keywords: eutrophication ; chironomids ; diatoms ; anoxia ; oxygen levels ; nutrients ; Ontario
    Source: Springer Online Journal Archives 1860-2000
    Topics: Biology , Geosciences
    Notes: Abstract Paleolimnological analyses were used to infer limnological changes during the past ~ 300 yrs in the west basin of Peninsula Lake, a small (853 ha) Precambrian Shield lake in Ontario, Canada, that has been subjected to moderate cultural disturbances (forest clearance, cottage and resort development). This study represents a pioneering attempt to use sedimentary chironomid assemblages and weighted-averaging models to quantify past hypolimnetic anoxia (expressed as the anoxic factor, AF). Impacts of forest clearance and human land-use on deepwater oxygen availability and surface water quality were assessed by comparing chironomid-inferred AF and diatom-inferred total phosphorus concentration ([TP]) to changes in terrestrial pollen and historical data. This study also discusses the ability of chironomids to quantitatively infer changes in AF.Pre-disturbance chironomid assemblages were stable and dominated by taxa indicative of oxygen-rich hypolimnetic conditions (e.g., Protanypus, Heterotrissocladius, Micropsectra type), while diatoms indicated oligotrophic lake status (diatom inferred [TP] = 5-7 μg·l-1). Chironomids characteristic of lower oxygen availability (e.g., Chironomus, Procladius) increased following land-clearance, road construction, establishment of a grist mill and lakeshore development beginning ca. 1870. Increased abundances of Tanytarsus s. lat., a multigeneric group of mainly littoral chironomids, since 1900, indicated that littoral chironomids may have comprised a greater proportion of fossil assemblages during periods of eutrophication and prolonged anoxia. Abundances of meso-eutrophic diatom taxa (e.g., Fragilaria crotonensis, Asterionella formosa, Aulacoseira ambigua, A. subarctica) increased concurrent with European settlement (ca. 1870) and diatom-inferred [TP] doubled (~ 6-12 μg·l-1), further indicating that naturally-oligotrophic Precambrian Shield lakes were extremely sensitive to initial land-clearance activities.Recent increases in oligotrophic diatom taxa (e.g., Cyclotella stelligera) indicate a shift to more oligotrophic conditions since ca. mid-1960s, with greatest changes since ca. 1980. The chironomids Heterotrissocladius and Micropsectra type also increased at this time suggesting greater deepwater oxygen availability. These recent water-quality improvements, possibly in response to enhanced nutrient removal from detergents and sewage, climate-related reductions in external phosphorus loads, and catchment (but not lake) acidification and reforestation, suggest that habitat for commercially-valuable cold-water fishes has improved in recent decades despite greater recreational lake-use.Paleolimnological assessment of trophic status changes in Peninsula Lake using fossil diatom and chironomid assemblages were in good agreement. Diatom inferences of [TP] and chironomid inferences of AF both suggest that Peninsula Lake was historically oligotrophic, became oligo-mesotrophic after European settlement, and returned to oligotrophy in recent yrs. Chironomid inferences of [TP] consistently underestimated the trophic status of Peninsula Lake, possibly due to its relatively large hypolimnion. These results suggest that AF represents a useful tool for quantitatively reconstructing the past trophic status of deeper, stratified lakes.
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