SVIBOR - Papers quoted in CC - project code: 1-07-193
MINISTRY OF SCIENCE AND TECHNOLOGY
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SVIBOR - Collecting Data on Projects in Croatia
Papers quoted in Current Contents on project 1-07-193
Quoted papers: 39
Other papers: 53
Total: 92
Title: Long Range Interaction Between Lone Pair Orbitals in
Diepoxynaphthalene Derivatives
- Authors:
- Eckert-Maksić, Mirjana (27544)
- Maksimović, Ljiljana (118321)
Journal: J. Org. Chem.
ISSN: 0022-3263
Volume: 56
Year: 1991
Pages: from 3719 to 3722
Number of references: 20
Language: engleski
Summary: Photoelectron spectroscopic analysis of exo,exo- and
endo,exo-bis-7-oxanorbornanes reveals considerable stronger interactions
between oxygen lone pairs in the former compounds.
Keywords: fused 7-oxanorbornanes, oxygen lone pairs interactions
Title: Theoretical Studies of the Solvent Effect on the Stability
of the Ascorbic Acid Tautomers
- Authors:
- Hoeweler, U.
- Baecker, Th.
- Klessinger, M.
- Eckert-Maksić, Mirjana (27544)
- Maksić, Zvonimir (27555)
Journal: Croat. Chem. Acta
ISSN: 0011-1643
Volume: 64
Year: 1991
Pages: from 539 to 549
Number of references: 15
Language: engleski
Summary: AM1 calculations on three conformers of each of the
fourtautomeric forms of ascorbic acid are reported. According to theresults
for isolated molecules, tautomer 3 should be lowest inenergy, whereas
experimentally only tautomer 1 is observed in thecrystal as well as in
solution. Solvent effects on the relativestability of the various
structures are assessed by applying acombined quantum chemical and force
field approach.
Keywords: vitamin C, ascorbic acid tautomers
Title: Fine Tuning of the Mills-Nixon Effect. Influence of
Substituents in some Benzocyclobutenes and Benzocyclobutadienes
- Authors:
- Eckert-Maksić, Mirjana (27544)
- Lesar, A.
- Maksić, Zvonimir (27555)
Journal: J. Chem. Soc. Perkin Trans. 2
ISSN: 0300-9580
Year: 1992
Pages: from 993 to 997
Number of references: 25
Language: engleski
Summary: A particular form of the 3-21G ab initio procedure is
employed inestimating structural features of
1,2-dihydrobenzocyclobutenesand benzocyclobutenes. The Mills-Nixon (MN)
type of bondshortening is identified in the parent hydrocarbon systems.
Itsextent can be amplified, diminished, completely cancelled orchanged in
sign depending on the electronegativity of thesubstituents at position 3.
Keywords: Mills-Nixon effect, rehybridization, electronegativity
Title: Thermally Induced Ring Opening of Novel Group 14
Functionalized Vinylcyclopropenes
- Authors:
- Eckert-Maksić, Mirjana (27544)
- Golić, Mirta (176395)
Journal: J. Chem. Soc. Perkin Trans. 2
ISSN: 0300-9580
Year: 1993
Pages: from 2325 to 2326
Number of references: 10
Language: engleski
Summary: Pyrolysis of
1,2-bis(Me3E)-3-methyl-3-vinylcyclopropenes(E=Si,Ge) and at 200 degrees is
found to yield allene- andalkyne-type products in the ratios 5:1 and 2:1,
respectively.
Keywords: 1,2-bis(Me3Si)-3-methyl-3-vinylcyclopropene, 1,2-bis(Me3Ge)-3-methyl-3-vinylcyclopropene, pyrolysis, spectroscopic properties
Title: Ionic Hydrogenation of Disubstituted Naphthalenes with
BF3-H2O-Et3SiH
- Authors:
- Eckert-Maksić, Mirjana (27544)
- Margetić, Davor (161124)
Journal: Energy and Fuels
ISSN: 0887-0624
Volume: 7
Year: 1993
Pages: from 315 to 318
Number of references: 18
Language: engleski
Summary: A number of dimethoxy-substituted naphthalenes and their
monoN(CH3)2 or SCH3 analogues are reduced by using Et3SiH or Et3SiDin boron
trifluoride monohydrate. Reaction mechanisms arediscussed on the basis of
ionic deuteration experiments. Themode of protonation of the starting
compounds is rationalized interms of proton affinities calculated by using
MNDO procedure.
Keywords: dimethoxynaphthalenes, ionic hydrogenation in BF3.H2O-Et3SiH
Title: Fluorination Effect on the Structural Properties in
Selected Benzocyclopropenes
- Authors:
- Koch, W.
- Eckert-Maksić, Mirjana (27544)
- Maksić, Zvonimir (27555)
Journal: J. Chem. Soc. Perkin Trans. 2
ISSN: 0300-9580
Year: 1993
Pages: from 2195 to 2202
Number of references: 50
Language: engleski
Summary: Structures and electronic aspects of mono- and
poly-annelatedbenzocyclopropenes and their gem-disubstituted
fluorinederivatives are examined theoretically at the HF/6-31G*
andMP2/6-31G* levels of theory. The computed geometries ofbenzocyclopropene
and gem-difluorinated benzocyclopropene are ingood qualitative agreement
with experimental information. Itappears that geminal difluorination leads
to a reversed oranti-Mills-Nixon (MN) distortion of the aromatic nucleus.
Keywords: Mills-Nixon and anti-Mills-Nixon distortion, rehybridization, pi-bond orders, hyperconjugation
Title: Protonation of Fused Aromatic Systems - Ab Initio Study of
some Model Wheland Intermediates
- Authors:
- Eckert-Maksić, Mirjana (27544)
- Klessinger, M.
- Maksić, Zvonimir (27555)
Journal: Int. J. Quantum Chem.
ISSN: 0020-7608
Volume: 49
Year: 1994
Pages: from 383 to 396
Number of references: 36
Language: engleski
Title: Theoretical Study of Wheland Intermediates in
Benzocycloalkenes-Vindication the Mills-Nixon Hypothesis
- Authors:
- Eckert-Maksić, Mirjana (27544)
- Maksić, Zvonimir (27555)
- Klessinger, M.
Journal: J. Chem. Soc. Perkin Trans. 2
ISSN: 0300-9580
Year: 1994
Pages: from 285 to 289
Number of references: 37
Language: engleski
Title: The Relative Stability of the Tautomers of
alpha-Hydroxytetronic Acid
- Authors:
- Baecker, Th.
- Klessinger, M.
- Eckert-Maksić, Mirjana (27544)
- Maksić, Zvonimir (27555)
Journal: Int. J. Quantum Chem.
ISSN: 0020-7608
Volume: 51
Year: 1994
Pages: from 385 to 394
Number of references: 12
Language: engleski
Title: One-electron Oxidation and Reduction Reactios of Vitamin C
Derivatives: 6-bromo- and 6-chloro-6-deoxy-Ascorbic Acid
- Authors:
- Bonifačić, Marija (4482)
- Ljubenkov, Ivica (185946)
- Eckert-Maksić, Mirjana (27544)
Journal: Int. J. Radiat. Biology
ISSN: 0955-3002
Volume: 66
Year: 1994
Pages: from 123 to 131
Number of references: 36
Language: engleski
Title: 6-Amino-6-deoxy-Ascorbic Acid induces Apoptosis in Huan
Tumor Cells
- Authors:
- Grdiša, Mirica (84375)
- Horvatić, M. (900152)
- Eckert-Maksić, Mirjana (27544)
- Pavelić, Krešimir (35262)
Journal: J. Cancer. Res. Clin. Onc.
ISSN: 0171-5216
Volume: 121
Year: 1995
Pages: from 98 to 102
Number of references: 31
Language: engleski
Title: Photoelectron Spectroscopic Study of Novel Group14
FunctionalizedVinylcyclopropenes
- Authors:
- Eckert-Maksić, Mirjana (27544)
- Golić, Mirta (176395)
- Paša-Tolić, Ljiljana (134150)
Journal: J. Organomet. Chem.
ISSN: 0022-328x
Volume: 489
Year: 1995
Pages: from 35 to 41
Number of references: 52
Language: engleski
Title: Linear vs. Angular Phenylenes. An Interplay of Aromaticity
and Bayer Strin in Fused Molecular Systems
- Authors:
- Maksić, Zvonimir (27555)
- Eckert-Maksić, Mirjana (27544)
- Boeckmann, M.
- Klessinger, M.
Journal: J. Phys. Chem.
ISSN: 0022-3654
Volume: 99
Year: 1995
Pages: from 6410 to 6416
Number of references: 33
Language: engleski
Title: Bent Bonds in Benzocyclopropenes and their Fluorinated
Derivatives
- Authors:
- Mo, O.
- Yanez, M.
- Eckert-Maksić, Mirjana (27544)
- Maksić, Zvonimir (27555)
Journal: J. Org. Chem.
ISSN: 0022-3115
Volume: 60
Year: 1995
Pages: from 1638 to 1646
Number of references: 62
Language: engleski
Title: Theoretical calculations of proton affinities in phenol
- Authors:
- Eckert-Maksić, Mirjana (27544)
- Klessinger, M.
- Maksić, Zvonimir (27555)
Journal: Chem. Phys. Letters
ISSN: 0009-2614
Volume: 232
Year: 1995
Pages: from 472 to 478
Number of references: 22
Language: engleski
Title: The Additivity of Proton Affinities - Theoretical Studies
of Fluoro- and Methyl Substituted Benzenes
- Authors:
- Eckert-Maksić, Mirjana (27544)
- Klessinger, M.
- Maksić, Zvonimir (27555)
Journal: J. Phys. Org. Chem.
ISSN: 0894-3230
Volume: 8
Year: 1995
Pages: from 435 to 441
Number of references: 26
Language: engleski
Title: Volumes of activation for catalysed Diels-Alder reactions
- Authors:
- Isaacs, N.S.
- Maksimović, Ljiljana (118321)
- Laila, A.
Journal: J. Chem. Soc. Perkin Trans. 2
ISSN: 0300-9580
Year: 1994
Pages: from 495 to 498
Language: engleski
Title: The synthesis of internally functionalised cavity
molecules using a cycloaddition strategy
- Authors:
- Warrener, R.N.
- Maksimović, Ljiljana (118321)
- Butler, D.N.
Journal: J. Chem. Soc. Chem. Commun.
Year: 1994
Pages: from 1831 to 1832
Language: engleski
Title: Evidence for olefinic intermediate in the configurational
inversion accompanying hydrogenolysis of a 7-oxanorbornyl vicinal dibromide
- Authors:
- Warrener, R.N.
- Maksimović, Ljiljana (118321)
Journal: Tetr. Lett.
ISSN: 0040-4039
Volume: 35
Year: 1994
Pages: from 2389 to 2392
Language: engleski
Title: Theoretical study of the electrophilic substitution
reactivity in benzocyclobutadiene and biphenylene
- Authors:
- Eckert-Maksić, Mirjana (27544)
- Fabian, W.M.F.
- Janoschek, R.
- Maksić, Zvonimir (27555)
Journal: J. Mol. Struct. Theochem.
Volume: 338
Year: 1995
Pages: from 1 to 10
Language: engleski
Information: svibor@znanost.hr
