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Ababsa S., Zouchoune B.
Electronic structure and relative stabilities
of 10- and 12-vertex. Closo- and nido-heteroborane clusters
of Ga, Ge and As elements
Keywords: boron-boron interactions, counting rules, atomic charges,
heteroatom substitution
Koudjina S., Atohoun Y.G.S., Houngue M.T.A.K., Kuevi U.A.,
Kpotin G.A., Kanhounnon W.G., Mensah J.B.
Modeling of oxolane hydrodeoxygenation in the presence
of tungsten disulfide
Keywords: oxolane, tungsten disulfide, hydrogenolysis, modeling,
catalytic hydrotreating, DFT/B3LYP, 6-31G(d), LanL2DZ
2018
302
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284
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2, 2018
Стр.2
Sargolzaei M., Afshar M., Nikoofard H.
Solvent effect on equilibrium and rate constant
of the tautomeric reaction
in Nexium, Skelaxin, Aldara
and Efavirenz drugs:
A DFT study
Keywords: tautomer, solvent, density functional theory,
RMSD, eyring
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(NH4)2ZrF6–InF3
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(III) (III):
DFT
: (III),
(III), ,
, ,
Vafaee A., Davoodnia A., Bozorgmehr M.R., Pordel M.
Characterization and molecular docking study of new
4-acetamidoalkyl pyrazoles as B-raf/COX-2 inhibitors
Keywords: synthesis, 4-acetamidoalkyl pyrazoles, molecular docking,
B-raf/COX-2 inhibitors
Suleimen Ye.., Van Hecke K., Ibatayev Zh.A.,
Akatan K.
Crystal structure of 1,2-bis(acetoxymethyl)-o-carborane
Keywords: 1,2-bis(acetoxymethyl)-o-carborane,
X-ray crystallographic analysis, NMR spectroscopy
356
347
340
334
326
318
309
Стр.3
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Mn1.5Ga1.5O4
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KDy- KTb-
: ,
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- (I) 2,5-()-1,3,4:
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,
402
398
391
384
378
368
359
Стр.4
.C., .., ..
[Cu(En)2CrO4]n
: - , -,
, ,
Fu W.-W., Shu X., Luo Y.-L., Tang Z.-Q., Li Q., Liu H.-J.,
Cheng Q.-W., Wang H.-Y., Liu Y.
New Co(II) and Mn(II) complexes with 4'-substituted
2,2':6',2''-terpyridine ligands
Keywords: Co(II) complex, Mn(II) complex, 4'-(4-methoxyphenyl)2,2':6',2''-terpyridine,
4'-(4-aminophenyl)-2,2':6',2''-terpyridine,
4'-(furan-2-yl)-2,2':6',2''-terpyridine
Ibragimov A.B., Englert U., Ashurov J.M., Wang A.
Dimorphism of hexaaquanickel(II) bis(p-nitrobenzoate)
dihydrate salt:
A new triclinic crystal form
Keywords: polymorphism, p-nitrobenzoic acid, Ni(II) complex,
hexaaqua cation, crystal structure, X-ray crystallography
Bhyrappa P., Sankar M., Karunanithi K., Varghese B.
Highly nonplanar macrocyclic ring conformation
in the crystal structures of Ni(II)
and Cu(II) octaphenylporphyrins
Keywords: substituted porphyrin, octaphenylporphyrin,
X-ray crystal structures, Hirshfeld surface analysis
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3-([d]-2-)-1-(2-(1,3,3--2))
-2(1H)-
: ,
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.., .., -..,
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{[Nd(phen)2(H2O)Nd(phen)(H2O)3 (-OH)2]×
×[Re4S4(CN)12]}·phen·3.5H2O
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446
442
438
428
425
409
412
Стр.5
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-9,10-
-9,10-
: -9,10-,
-9,10-,
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-
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Sabbaghan M., Adhami F., Aminnezhad M.
Mesoporous jarosite/MnO2 and goethite/MnO2
nanocomposites:
Synthesis and application for oxidation
of methylene blue
Keywords: MnO2, jarosite, goethite, Fenton-like catalyst,
methylene blue
Aribi K., Ghelamallah M., Bellifa A., Granger P.,
Choukchou-Braham A.
Structural and textural modifications of ZrO2 induced by
La2O3 addition, thermal treatment and reducing process
Keywords: ZrO2, La2O3, surface, structure, TPRH2, pyrochlore oxide
Fardood S. Taghavi, Ramazani A., Joo S.W.
Green chemistry approach for the synthesis of copper oxide
nanoparticles using tragacanth gel and their structural
characterization
Keywords: tragacanth gel, copper oxide nanoparticles,
nanobiotechnology, natural hydrogel, sol-gel
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494
486
476
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Стр.6
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, 2017
Стр.7