DOI: 10.1021/jp021775s. The Benzene/Water/Hexafluorobenzene Complex: A Computational Study

The Benzene/Water/Hexafluorobenzene Complex: A Computational Study

10.1021/jp021775s

Crossref journal-article

American Chemical Society (ACS)

The Journal of Physical Chemistry A (316)

Bibliography

Raimondi, M., Calderoni, G., Famulari, A., Raimondi, L., & Cozzi, F. (2003). The Benzene/Water/Hexafluorobenzene Complex:â A Computational Study. The Journal of Physical Chemistry A, 107(6), 772â774.

Authors 5

Mario Raimondi (first)
Gabriele Calderoni (additional)
Antonino Famulari (additional)
Laura Raimondi (additional)
Franco Cozzi (additional)

References 36 Referenced 54

10.1006/jmbi.1993.1217 / J. Mol. Biol. by Hunter C. A. (1993)
10.1002/3527607439 / Supramolecular Chemistry. Concepts and Perspectives by Lehn J.-M. (1995)
Chin, D. N.; Zerkowski, J. A.; MacDonald, J. C.; Whitesides, G. M. InOrganized Molecular Assemblies in the Solid State; Whitesell, J. K., Ed.; Wiley: New York, 1999; p 185.
10.1021/j100008a015 / J. Phys. Chem. by Hua I. (1995)
10.1126/science.257.5072.942 / Science by Suzuki S. (1992)
10.1021/jp9535710 / J. Phys. Chem. by Fredericks S. Y. (1996)
10.1021/jp991932w / J. Phys. Chem. A by Feller D. (1999)
10.1021/ja001901a / J. Am. Chem. Soc. by Tsuzuki S. (2000)
10.1016/S0009-2614(96)01473-X / Chem. Phys. Lett. by Kim K, S (1997)
10.1063/1.475953 / J. Chem. Phys. by Furutaka S. (1998)
10.1063/1.1287596 / J. Chem. Phys. by Besnard M. (2000)
10.1021/jp951581v / J. Phys. Chem. by Nakahara M. (1996)
10.1016/S0924-2031(00)00076-X / Vibr. Spectrosc. by Tassaing T. (2000)
10.1126/science.271.5246.163 / Science by Dougherty D. A. (1996)
10.1039/f29807600648 / J. Chem. Soc., Faraday Trans.2 by Vrbancich J. (1980)
10.1021/ar00035a005 / Acc. Chem. Res. by Williams J. H. (1993)
{'key': 'jp021775sb00008/jp021775sb00008_3', 'first-page': '603', 'volume': '131', 'author': 'Luhmer M.', 'year': '1994', 'journal-title': 'Bull. Chem. Soc. Fr.'} / Bull. Chem. Soc. Fr. by Luhmer M. (1994)
10.1021/ol990577p / Org. Lett. by Gallivan J. P. (1999)
10.1021/jp984726h / J. Phys. Chem. A by Danten Y. (1999)
10.1002/chem.19970030115 / Chem. Eur. J. by Dunitz J. D.. (1997)
10.1021/jo970125v / J. Org. Chem. by Alkorta I. (1997)
{'key': 'jp021775sb00010/jp021775sb00010_2', 'volume': '124', 'author': 'Alkorta I.', 'year': '2002', 'journal-title': 'J. Am. Chem. Soc.'} / J. Am. Chem. Soc. by Alkorta I. (2002)
10.1038/1871021a0 / Nature by Patrick C. R. (1960)
10.3891/acta.chem.scand.42a-0001 / Acta Chem. Scandinavica by Dahl T. (1988)
10.1002/anie.199216551 / Angew. Chem., Int. Ed. Engl. by Williams J. H. (1992)
10.1002/anie.199702481 / Angew. Chem., Int. Ed. Engl. by Coates G. W. (1997)
10.1021/jo960533j / J. Org. Chem. by Gillard R. E. (1996)
10.1002/anie.199510191 / Angew. Chem., Int. Ed. Engl. by Cozzi F. (1995)
10.1002/1521-3773(20000703)39:13<2323::AID-ANIE2323>3.0.CO;2-X / Angew. Chem. Int. Ed. Engl. by Ponzini F. (2000)
10.1021/ja011034p / J. Am. Chem. Soc. by Kim C.-Y. (2001)
10.1002/jcc.540141112 / J. Comput. Chem. by Schmidt M. W. (1993)
10.1002/(SICI)1097-461X(1998)69:2<151::AID-QUA2>3.0.CO;2-U / Int. J. Quantum Chem. by Gianinetti E. (1998)
10.1002/(SICI)1097-461X(1998)69:2<151::AID-QUA2>3.0.CO;2-U / Int. J. Quantum Chem. by Famulari A. (1998)
{'key': 'jp021775sb00015/jp021775sb00015_1', 'first-page': '566', 'volume': '19', 'author': 'Boys S. F.', 'year': '1970', 'journal-title': 'Mol. Phys.'} / Mol. Phys. by Boys S. F. (1970)
10.1021/jp953306e / J. Phys. Chem. by Sponer J. (1996)
10.1016/S0166-1280(01)00535-8 / J. Mol. Struct.(THEOCHEM) by For (2001)

Dates

Type	When
Created	22 years, 6 months ago (Feb. 6, 2003, 12:51 a.m.)
Deposited	3 years, 11 months ago (Sept. 23, 2021, 12:58 a.m.)
Indexed	1 year, 1 month ago (June 30, 2024, 11:08 a.m.)
Issued	22 years, 7 months ago (Jan. 18, 2003)
Published	22 years, 7 months ago (Jan. 18, 2003)
Published Online	22 years, 7 months ago (Jan. 18, 2003)
Published Print	22 years, 6 months ago (Feb. 1, 2003)

Funders 0

None

BibTeX

@article{Raimondi_2003, title={The Benzene/Water/Hexafluorobenzene Complex: A Computational Study}, volume={107}, ISSN={1520-5215}, url={http://dx.doi.org/10.1021/jp021775s}, DOI={10.1021/jp021775s}, number={6}, journal={The Journal of Physical Chemistry A}, publisher={American Chemical Society (ACS)}, author={Raimondi, Mario and Calderoni, Gabriele and Famulari, Antonino and Raimondi, Laura and Cozzi, Franco}, year={2003}, month=jan, pages={772–774} }

JSON

{
  "indexed": {
    "date-parts": [
      [
        2024,
        6,
        30
      ]
    ],
    "date-time": "2024-06-30T15:08:58Z",
    "timestamp": 1719760138398
  },
  "reference-count": 36,
  "publisher": "American Chemical Society (ACS)",
  "issue": "6",
  "content-domain": {
    "domain": [],
    "crossmark-restriction": false
  },
  "published-print": {
    "date-parts": [
      [
        2003,
        2,
        1
      ]
    ]
  },
  "DOI": "10.1021/jp021775s",
  "type": "journal-article",
  "created": {
    "date-parts": [
      [
        2003,
        2,
        6
      ]
    ],
    "date-time": "2003-02-06T05:51:05Z",
    "timestamp": 1044510665000
  },
  "page": "772-774",
  "source": "Crossref",
  "is-referenced-by-count": 54,
  "title": "The Benzene/Water/Hexafluorobenzene Complex:\u2009 A Computational Study",
  "prefix": "10.1021",
  "volume": "107",
  "author": [
    {
      "given": "Mario",
      "family": "Raimondi",
      "sequence": "first",
      "affiliation": [
        {
          "name": "Dipartimento di Chimica Fisica ed Elettrochimica and Centro di Eccellenza CISI, Dipartimento di Chimica Organica e Industriale and Centro di Eccellenza CISI, and CNR-ISTM and Centro di Eccellenza CISI, Universit\u00e0 di Milano, via Golgi 19, 20133 Milano, Italy"
        }
      ]
    },
    {
      "given": "Gabriele",
      "family": "Calderoni",
      "sequence": "additional",
      "affiliation": [
        {
          "name": "Dipartimento di Chimica Fisica ed Elettrochimica and Centro di Eccellenza CISI, Dipartimento di Chimica Organica e Industriale and Centro di Eccellenza CISI, and CNR-ISTM and Centro di Eccellenza CISI, Universit\u00e0 di Milano, via Golgi 19, 20133 Milano, Italy"
        }
      ]
    },
    {
      "given": "Antonino",
      "family": "Famulari",
      "sequence": "additional",
      "affiliation": [
        {
          "name": "Dipartimento di Chimica Fisica ed Elettrochimica and Centro di Eccellenza CISI, Dipartimento di Chimica Organica e Industriale and Centro di Eccellenza CISI, and CNR-ISTM and Centro di Eccellenza CISI, Universit\u00e0 di Milano, via Golgi 19, 20133 Milano, Italy"
        }
      ]
    },
    {
      "given": "Laura",
      "family": "Raimondi",
      "sequence": "additional",
      "affiliation": [
        {
          "name": "Dipartimento di Chimica Fisica ed Elettrochimica and Centro di Eccellenza CISI, Dipartimento di Chimica Organica e Industriale and Centro di Eccellenza CISI, and CNR-ISTM and Centro di Eccellenza CISI, Universit\u00e0 di Milano, via Golgi 19, 20133 Milano, Italy"
        }
      ]
    },
    {
      "given": "Franco",
      "family": "Cozzi",
      "sequence": "additional",
      "affiliation": [
        {
          "name": "Dipartimento di Chimica Fisica ed Elettrochimica and Centro di Eccellenza CISI, Dipartimento di Chimica Organica e Industriale and Centro di Eccellenza CISI, and CNR-ISTM and Centro di Eccellenza CISI, Universit\u00e0 di Milano, via Golgi 19, 20133 Milano, Italy"
        }
      ]
    }
  ],
  "member": "316",
  "published-online": {
    "date-parts": [
      [
        2003,
        1,
        18
      ]
    ]
  },
  "reference": [
    {
      "key": "jp021775sb00001/jp021775sb00001_1",
      "doi-asserted-by": "crossref",
      "first-page": "1025",
      "DOI": "10.1006/jmbi.1993.1217",
      "volume": "230",
      "author": "Hunter C. A.",
      "year": "1993",
      "journal-title": "J. Mol. Biol."
    },
    {
      "key": "jp021775sb00002/jp021775sb00002_1",
      "doi-asserted-by": "crossref",
      "DOI": "10.1002/3527607439",
      "volume-title": "Supramolecular Chemistry. Concepts and Perspectives",
      "author": "Lehn J.-M.",
      "year": "1995"
    },
    {
      "key": "jp021775sb00003/jp021775sb00003_1",
      "unstructured": "Chin, D. N.; Zerkowski, J. A.; MacDonald, J. C.; Whitesides, G. M. InOrganized Molecular Assemblies in the Solid State; Whitesell, J. K., Ed.; Wiley:\u2009 New York, 1999; p 185."
    },
    {
      "key": "jp021775sb00004/jp021775sb00004_1",
      "doi-asserted-by": "crossref",
      "first-page": "2335",
      "DOI": "10.1021/j100008a015",
      "volume": "99",
      "author": "Hua I.",
      "year": "1995",
      "journal-title": "J. Phys. Chem."
    },
    {
      "key": "jp021775sb00005/jp021775sb00005_1",
      "doi-asserted-by": "crossref",
      "first-page": "942",
      "DOI": "10.1126/science.257.5072.942",
      "volume": "257",
      "author": "Suzuki S.",
      "year": "1992",
      "journal-title": "Science"
    },
    {
      "key": "jp021775sb00005/jp021775sb00005_2",
      "doi-asserted-by": "crossref",
      "first-page": "7810",
      "DOI": "10.1021/jp9535710",
      "volume": "100",
      "author": "Fredericks S. Y.",
      "year": "1996",
      "journal-title": "J. Phys. Chem."
    },
    {
      "key": "jp021775sb00005/jp021775sb00005_3",
      "doi-asserted-by": "crossref",
      "first-page": "7558",
      "DOI": "10.1021/jp991932w",
      "volume": "103",
      "author": "Feller D.",
      "year": "1999",
      "journal-title": "J. Phys. Chem. A"
    },
    {
      "key": "jp021775sb00005/jp021775sb00005_4",
      "doi-asserted-by": "crossref",
      "first-page": "11450",
      "DOI": "10.1021/ja001901a",
      "volume": "122",
      "author": "Tsuzuki S.",
      "year": "2000",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "jp021775sb00005/jp021775sb00005_5",
      "doi-asserted-by": "crossref",
      "first-page": "497",
      "DOI": "10.1016/S0009-2614(96)01473-X",
      "volume": "265",
      "author": "Kim K, S",
      "year": "1997",
      "journal-title": "Chem. Phys. Lett."
    },
    {
      "key": "jp021775sb00006/jp021775sb00006_1",
      "doi-asserted-by": "crossref",
      "first-page": "5159",
      "DOI": "10.1063/1.475953",
      "volume": "108",
      "author": "Furutaka S.",
      "year": "1998",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "jp021775sb00006/jp021775sb00006_2",
      "doi-asserted-by": "crossref",
      "first-page": "3741",
      "DOI": "10.1063/1.1287596",
      "volume": "113",
      "author": "Besnard M.",
      "year": "2000",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "jp021775sb00006/jp021775sb00006_3",
      "doi-asserted-by": "crossref",
      "first-page": "1345",
      "DOI": "10.1021/jp951581v",
      "volume": "100",
      "author": "Nakahara M.",
      "year": "1996",
      "journal-title": "J. Phys. Chem."
    },
    {
      "key": "jp021775sb00006/jp021775sb00006_4",
      "doi-asserted-by": "crossref",
      "first-page": "15",
      "DOI": "10.1016/S0924-2031(00)00076-X",
      "volume": "24",
      "author": "Tassaing T.",
      "year": "2000",
      "journal-title": "Vibr. Spectrosc."
    },
    {
      "key": "jp021775sb00007/jp021775sb00007_1",
      "doi-asserted-by": "crossref",
      "first-page": "163",
      "DOI": "10.1126/science.271.5246.163",
      "volume": "271",
      "author": "Dougherty D. A.",
      "year": "1996",
      "journal-title": "Science"
    },
    {
      "key": "jp021775sb00008/jp021775sb00008_1",
      "doi-asserted-by": "crossref",
      "first-page": "648",
      "DOI": "10.1039/f29807600648",
      "volume": "76",
      "author": "Vrbancich J.",
      "year": "1980",
      "journal-title": "J. Chem. Soc., Faraday Trans.2"
    },
    {
      "key": "jp021775sb00008/jp021775sb00008_2",
      "doi-asserted-by": "crossref",
      "first-page": "593",
      "DOI": "10.1021/ar00035a005",
      "volume": "26",
      "author": "Williams J. H.",
      "year": "1993",
      "journal-title": "Acc. Chem. Res."
    },
    {
      "key": "jp021775sb00008/jp021775sb00008_3",
      "first-page": "603",
      "volume": "131",
      "author": "Luhmer M.",
      "year": "1994",
      "journal-title": "Bull. Chem. Soc. Fr."
    },
    {
      "key": "jp021775sb00009/jp021775sb00009_1",
      "doi-asserted-by": "crossref",
      "first-page": "103",
      "DOI": "10.1021/ol990577p",
      "volume": "1",
      "author": "Gallivan J. P.",
      "year": "1999",
      "journal-title": "Org. Lett."
    },
    {
      "key": "jp021775sb00009/jp021775sb00009_2",
      "doi-asserted-by": "crossref",
      "first-page": "3530",
      "DOI": "10.1021/jp984726h",
      "volume": "103",
      "author": "Danten Y.",
      "year": "1999",
      "journal-title": "J. Phys. Chem. A"
    },
    {
      "key": "jp021775sb00009/jp021775sb00009_3",
      "doi-asserted-by": "crossref",
      "first-page": "89",
      "DOI": "10.1002/chem.19970030115",
      "volume": "3",
      "author": "Dunitz J. D..",
      "year": "1997",
      "journal-title": "Chem. Eur. J."
    },
    {
      "key": "jp021775sb00010/jp021775sb00010_1",
      "doi-asserted-by": "crossref",
      "first-page": "4687",
      "DOI": "10.1021/jo970125v",
      "volume": "62",
      "author": "Alkorta I.",
      "year": "1997",
      "journal-title": "J. Org. Chem."
    },
    {
      "key": "jp021775sb00010/jp021775sb00010_2",
      "volume": "124",
      "author": "Alkorta I.",
      "year": "2002",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "jp021775sb00011/jp021775sb00011_1",
      "doi-asserted-by": "crossref",
      "first-page": "1021",
      "DOI": "10.1038/1871021a0",
      "volume": "187",
      "author": "Patrick C. R.",
      "year": "1960",
      "journal-title": "Nature"
    },
    {
      "key": "jp021775sb00011/jp021775sb00011_2",
      "doi-asserted-by": "crossref",
      "first-page": "1",
      "DOI": "10.3891/acta.chem.scand.42a-0001",
      "volume": "42",
      "author": "Dahl T.",
      "year": "1988",
      "journal-title": "Acta Chem. Scandinavica"
    },
    {
      "key": "jp021775sb00011/jp021775sb00011_3",
      "doi-asserted-by": "crossref",
      "first-page": "1655",
      "DOI": "10.1002/anie.199216551",
      "volume": "31",
      "author": "Williams J. H.",
      "year": "1992",
      "journal-title": "Angew. Chem., Int. Ed. Engl."
    },
    {
      "key": "jp021775sb00012/jp021775sb00012_1",
      "doi-asserted-by": "crossref",
      "first-page": "248",
      "DOI": "10.1002/anie.199702481",
      "volume": "36",
      "author": "Coates G. W.",
      "year": "1997",
      "journal-title": "Angew. Chem., Int. Ed. Engl."
    },
    {
      "key": "jp021775sb00012/jp021775sb00012_2",
      "doi-asserted-by": "crossref",
      "first-page": "4504",
      "DOI": "10.1021/jo960533j",
      "volume": "61",
      "author": "Gillard R. E.",
      "year": "1996",
      "journal-title": "J. Org. Chem."
    },
    {
      "key": "jp021775sb00012/jp021775sb00012_3",
      "doi-asserted-by": "crossref",
      "first-page": "1019",
      "DOI": "10.1002/anie.199510191",
      "volume": "34",
      "author": "Cozzi F.",
      "year": "1995",
      "journal-title": "Angew. Chem., Int. Ed. Engl."
    },
    {
      "key": "jp021775sb00012/jp021775sb00012_4",
      "doi-asserted-by": "crossref",
      "first-page": "2323",
      "DOI": "10.1002/1521-3773(20000703)39:13<2323::AID-ANIE2323>3.0.CO;2-X",
      "volume": "39",
      "author": "Ponzini F.",
      "year": "2000",
      "journal-title": "Angew. Chem. Int. Ed. Engl."
    },
    {
      "key": "jp021775sb00012/jp021775sb00012_5",
      "doi-asserted-by": "crossref",
      "first-page": "9620",
      "DOI": "10.1021/ja011034p",
      "volume": "123",
      "author": "Kim C.-Y.",
      "year": "2001",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "jp021775sb00013/jp021775sb00013_1",
      "doi-asserted-by": "crossref",
      "first-page": "1347",
      "DOI": "10.1002/jcc.540141112",
      "volume": "14",
      "author": "Schmidt M. W.",
      "year": "1993",
      "journal-title": "J. Comput. Chem."
    },
    {
      "key": "jp021775sb00014/jp021775sb00014_1",
      "doi-asserted-by": "crossref",
      "first-page": "151",
      "DOI": "10.1002/(SICI)1097-461X(1998)69:2<151::AID-QUA2>3.0.CO;2-U",
      "volume": "69",
      "author": "Gianinetti E.",
      "year": "1998",
      "journal-title": "Int. J. Quantum Chem."
    },
    {
      "key": "jp021775sb00014/jp021775sb00014_2",
      "doi-asserted-by": "crossref",
      "first-page": "151",
      "DOI": "10.1002/(SICI)1097-461X(1998)69:2<151::AID-QUA2>3.0.CO;2-U",
      "volume": "69",
      "author": "Famulari A.",
      "year": "1998",
      "journal-title": "Int. J. Quantum Chem."
    },
    {
      "key": "jp021775sb00015/jp021775sb00015_1",
      "first-page": "566",
      "volume": "19",
      "author": "Boys S. F.",
      "year": "1970",
      "journal-title": "Mol. Phys."
    },
    {
      "key": "jp021775sb00016/jp021775sb00016_1",
      "doi-asserted-by": "crossref",
      "first-page": "5590",
      "DOI": "10.1021/jp953306e",
      "volume": "100",
      "author": "Sponer J.",
      "year": "1996",
      "journal-title": "J. Phys. Chem."
    },
    {
      "key": "jp021775sb00017/jp021775sb00017_1",
      "doi-asserted-by": "crossref",
      "first-page": "25",
      "DOI": "10.1016/S0166-1280(01)00535-8",
      "volume": "573",
      "author": "For",
      "year": "2001",
      "journal-title": "J. Mol. Struct.(THEOCHEM)"
    }
  ],
  "container-title": "The Journal of Physical Chemistry A",
  "original-title": [],
  "language": "en",
  "link": [
    {
      "URL": "https://pubs.acs.org/doi/pdf/10.1021/jp021775s",
      "content-type": "unspecified",
      "content-version": "vor",
      "intended-application": "similarity-checking"
    }
  ],
  "deposited": {
    "date-parts": [
      [
        2021,
        9,
        23
      ]
    ],
    "date-time": "2021-09-23T04:58:37Z",
    "timestamp": 1632373117000
  },
  "score": 1,
  "resource": {
    "primary": {
      "URL": "https://pubs.acs.org/doi/10.1021/jp021775s"
    }
  },
  "subtitle": [],
  "short-title": [],
  "issued": {
    "date-parts": [
      [
        2003,
        1,
        18
      ]
    ]
  },
  "references-count": 36,
  "journal-issue": {
    "issue": "6",
    "published-print": {
      "date-parts": [
        [
          2003,
          2,
          1
        ]
      ]
    }
  },
  "alternative-id": [
    "10.1021/jp021775s"
  ],
  "URL": "http://dx.doi.org/10.1021/jp021775s",
  "relation": {},
  "ISSN": [
    "1089-5639",
    "1520-5215"
  ],
  "subject": [],
  "container-title-short": "J. Phys. Chem. A",
  "published": {
    "date-parts": [
      [
        2003,
        1,
        18
      ]
    ]
  }
}