1. Ab initio study of the structure and electronic properties of magnesium and calcium nitrates and their crystal hydrates

   • Yu. N. Zhuravlev
   • D. V. Korabel`nikov

   OriginalPaper 15 September 2017 Pages: 641 - 649

2. Structure–reactivity relationship in Diels–Alder reactions obtained using the condensed reaction graph approach

   • T. I. Madzhidov
   • T. R. Gimadiev
   • A. A. Varnek

   OriginalPaper 15 September 2017 Pages: 650 - 656

3. A DFT study on the structural and electronic properties of small toxic gases on B- and Al- doped C₂₀ fullerene

   • F. Molani
   • M. Askari

   OriginalPaper 15 September 2017 Pages: 657 - 666

4. Theoretical studies of the spin Hamiltonian parameters and local structures for Ag²⁺ in AgCl and KCl crystals

   • L.-J. Zhang
   • S.-Y. Wu
   • G.-L. Li

   OriginalPaper 15 September 2017 Pages: 667 - 674

5. Density functional theory insight into Eu(III) and Am(III) complexes with two 2,6-dicarboxypyridine diamide-type ligands

   • Y. Yang
   • Y. Fang
   • S. Luo

   OriginalPaper 15 September 2017 Pages: 675 - 683

6. DFT/TDDFT investigation on the electronic structures and spectral characteristics of C₅H₃XOS (X = H, F, Cl or Br)

   • E. Güneş
   • C. Parlak
   • M. Şenyel

   OriginalPaper 15 September 2017 Pages: 684 - 693

7. Crystal structure and ^121,123Sb NQR parameters of ammonium tridecafluorotetraantimonate(III) NH₄Sb₄F₁₃

   • L. A. Zemnukhova
   • A. A. Udovenko
   • T. A. Babushkina

   OriginalPaper 15 September 2017 Pages: 694 - 699

8. Studies on the g-factors of the copper(II)–oxygen compounds

   • G.-L. Li
   • S.-Y. Wu
   • Y.-Q. Xu

   OriginalPaper 15 September 2017 Pages: 700 - 705

9. Prediction of changes in the heat capacity of the liquid–vapor phase transition based on modified Randič indices. Alkanes and oxygen-containing compounds

   • E. L. Krasnykh
   • S. V. Portnova

   OriginalPaper 15 September 2017 Pages: 706 - 711

10. To evaluation of the state of the own macroscopic force field of liquids

    • V. N. Kartsev
    • S. N. Shtykov
    • K. E. Pankin

    OriginalPaper 15 September 2017 Pages: 712 - 717

11. Crystal structures of binuclear Bi(III) chloride and bromide complexes with some cations — Alkylated pyridine derivatives

    • S. A. Adonin
    • I. D. Gorokh
    • V. P. Fedin

    OriginalPaper 15 September 2017 Pages: 718 - 723

12. Spectroscopic characterization and room-temperature structure of bis(4-aminopyridinium) dichromate

    • R. Ben Smail
    • H. Chebbi
    • M. F. Zid

    OriginalPaper 15 September 2017 Pages: 724 - 733

13. The first chromate containing both Cr₂O₇ and Cr₃O₁₀ groups, bis(1,3-bis(4-piperidinium)propane) dichromate trichromate monohydrate: Synthesis and crystal structure

    • R. Ben Smail
    • M. F. Zid
    • A. Driss

    OriginalPaper 15 September 2017 Pages: 734 - 741

14. Crystal structure and spectroscopic properties of isothiocyanato[(3,14-dimethyl-2,6,13,17-tetraazatricyclo(16.4.0.0^7,12)docosane)]copper(II) thiocyanate

    • M. A. Subhan
    • S. W. Ng
    • J.-H. Choi

    OriginalPaper 15 September 2017 Pages: 742 - 749

15. Two new cadmium(II) coordination polymers with bis(benzimidazole) ligands

    • X.-B. Liu
    • Y.-Q. Zhao
    • G.-H. Cui

    OriginalPaper 15 September 2017 Pages: 750 - 757

16. Structure of a new chelate complex MO₂O₃(dpm)₄

    • A. Yu. Ledneva
    • S. B. Artemkina
    • V. E. Fedorov

    OriginalPaper 15 September 2017 Pages: 758 - 762

17. Molecular and crystal structure of 1,1-bis(methoxy-NNO-azoxy)-3,3,3-trinitropropane

    • I. N. Zyuzin
    • Z. G. Aliev
    • S. M. Aldoshin

    OriginalPaper 15 September 2017 Pages: 763 - 766

18. Relationship between the structure and physicochemical characteristics of 1,2,3,4-tetrahydroquinoline derivatives

    • N. A. Nekrasova
    • S. V. Kurbatova

    OriginalPaper 15 September 2017 Pages: 767 - 774

19. Palladium-containing composite nanomaterials based on polycaprolactam: Formation and structure

    • I. D. Akhmadov
    • N. E. Mel′nikova
    • V. M. Akhmedov

    OriginalPaper 15 September 2017 Pages: 775 - 781

20. Topology of supramolecular structures in ethanol solutions

    • A. M. Tolmachev
    • A. V. Klimov
    • D. A. Firsov

    OriginalPaper 15 September 2017 Pages: 782 - 788

21. Effect of protonation on the structure of 1,3,6,8-tetraazatricyclo[4.4.1.1^3,8] dodecane (TATD) adamanzane: Crystal structure and DFT analysis of 3,6,8-triaza-1-azoniatricyclo[4.4.1.1^3,8]dodecane 4-nitrophenolate 4-nitrophenol

    • A. Rivera
    • J. M. Uribe
    • M. Bolte

    OriginalPaper 15 September 2017 Pages: 789 - 796

22. Structure and urease inhibitory activity of copper(II) complex with (E)-3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acrylic acid

    • X.-F. Chen
    • C.-F. Wang
    • H.-L. Zhu

    OriginalPaper 15 September 2017 Pages: 797 - 803

23. X-ray crystal structure and conformational flexibility study of a N-substituted 2,6-diphenylpiperidine derivative

    • N. Sampath

    OriginalPaper 15 September 2017 Pages: 804 - 808

24. Cubic cation framework in trigonal structures of tourmalins: The core of structural type stability

    • S. V. Borisov
    • N. V. Pervukhina
    • S. A. Magarill

    Brief Communications 15 September 2017 Pages: 809 - 812

25. Crystal structure of rubidium and cesium tetrafluoroindate(III) dihydrates

    • R. L. Davidovich
    • V. B. Logvinova
    • G. V. Shilov

    Brief Communications 15 September 2017 Pages: 813 - 816

26. Crystal structure of Na₃[TaO₈]·14H₂O

    • P. A. Abramov
    • A. A. Shmakova
    • M. N. Sokolov

    Brief Communications 15 September 2017 Pages: 817 - 820

27. Crystal structure of potassium β-tetrafluoroantimonate(III) (β-KSbF₄)

    • A. A. Udovenko
    • L. A. Zemnukhova
    • N. V. Makarenko

    Brief Communications 15 September 2017 Pages: 821 - 823

28. Hexanuclear Na(I) complex with 3,5-dimethyl-1H-pyrazole and its anion

    • K. A. Vinogradova
    • P. A. Stabnikov
    • Yu. M. Rumyantsev

    Brief Communications 15 September 2017 Pages: 824 - 827

29. Crystal structure of the copper(II) complex with acetylacetone and ethylenediamine obtained by template synthesis

    • A. M. Maharramov
    • M. G. Tsintsadze
    • F. M. Chyragov

    Brief Communications 15 September 2017 Pages: 828 - 830

30. New volatile zirconium(IV) complex with methoxy substituted β-diketonate

    • V. V. Krisyuk
    • I. A. Baidina
    • I. K. Igumenov

    Brief Communications 15 September 2017 Pages: 831 - 834

31. Structural characterization of a bioctahedral cluster [Re₁₂CS₁₄(μ-SO₂)(μ-S)₂(CN)₆]^6– anion

    • T. I. Lappi
    • Ya. M. Gayfulin
    • Yu. V. Mironov

    Brief Communications 15 September 2017 Pages: 835 - 837

32. Crystal structure of a new binuclear complex of bis(2,4,6,8-tetramethyl-2,4,6,8-tetraazabicyclo(3.3.0)octane -3,7-dione-O, O′)-diaqua-hexakis(nitrato-O,O′)-digadolinium(III) monohydrate

    • E. E. Netreba
    • N. V. Somov

    Brief Communications 15 September 2017 Pages: 838 - 842

33. Structure of lanthanum(III) tris-dipivaloylmethanate

    • Lu Yuikhan
    • S. A. Mosyagina
    • N. B. Morozova

    Brief Communications 15 September 2017 Pages: 843 - 846

34. IR spectroscopic study of H complexes of dioxolane derivatives with methanol in CCl₄ solutions

    • N. U. Mulloev
    • J. Yusupova
    • B. I. Makhsudov

    Brief Communications 15 September 2017 Pages: 847 - 849

35. Crystal structure of 2-(2-morpholinoacetyl) hydrazinocarbothioamide

    • K. M. Turdybekov
    • O. A. Nurkenov
    • A. S. Utegenova

    Brief Communications 15 September 2017 Pages: 850 - 851