A quantum-chemical study of carbon sandwich compounds

被引：23
|
作者：
Minyaev, RM [1 ]
Minkin, VI [1 ]
Gribanova, TN [1 ]
机构：
[1] Rostov State Univ, Russian Acad Sci, So Res Ctr, Inst Phys & Organ Chem, Rostov Na Donu 344090, Russia
来源：
MENDELEEV COMMUNICATIONS | 2004年 / 14卷 / 03期
基金：
俄罗斯基础研究基金会;
关键词：
D O I：
10.1070/MC2004v014n03ABEH001917
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
Ab initio [MP2(fu)/6-311+G**] and DFT (B3LYP/6-311+G**) calculations predict highly symmetrical stable structures of sandwich compounds with a central carbon atom between three-, four- and five-membered (BH)(n) rings.
引用
收藏
页码：96 / 98
页数：3
相关论文
共 50 条
  • [31] UPS AND QUANTUM-CHEMICAL STUDY OF COMPOUNDS CONTAINING SINCO, SINCS GROUPS
    VESZPREMI, T
    PASINSZKI, T
    NYULASZI, L
    CSONKA, G
    BARTA, I
    JOURNAL OF MOLECULAR STRUCTURE, 1988, 175 : 411 - 416
  • [32] A quantum-chemical study of carbon dioxide interactions with acetonitrile, formaldehyde, and ethylene
    Fedotov, AN
    Simonov, AP
    RUSSIAN JOURNAL OF PHYSICAL CHEMISTRY, 1999, 73 (10): : 1667 - 1670
  • [33] Sandwich compounds of second-row elements: a quantum chemical study
    Gribanova, T. N.
    Minyaev, R. M.
    Minkin, V. I.
    RUSSIAN CHEMICAL BULLETIN, 2006, 55 (11) : 1893 - 1903
  • [34] Sandwich compounds of second-row elements: A quantum chemical study
    T. N. Gribanova
    R. M. Minyaev
    V. I. Minkin
    Russian Chemical Bulletin, 2006, 55 : 1893 - 1903
  • [35] Quantum-Chemical Comprehensive Study of the Organophosphorus Compounds Adsorption on Zinc Oxide Surfaces
    Paukku, Y.
    Michalkova, A.
    Leszczynski, J.
    JOURNAL OF PHYSICAL CHEMISTRY C, 2009, 113 (04): : 1474 - 1485
  • [36] Quantum-chemical study on nitrosonium complexes of Bi- and polycyclic aromatic compounds
    R. V. Andreev
    G. I. Borodkin
    V. G. Shubin
    Russian Journal of Organic Chemistry, 2012, 48 : 52 - 58
  • [37] QUANTUM-CHEMICAL STUDY OF THE OXIDATION OF AROMATIC-COMPOUNDS BY MOLECULAR-OXYGEN
    BORISOV, YA
    DOKLADY AKADEMII NAUK SSSR, 1991, 316 (05): : 1140 - 1144
  • [38] QUANTUM-CHEMICAL STUDY OF MECHANISM OF NUCLEOPHILIC-ADDITION TO CARBONYL-COMPOUNDS
    BURSHTEIN, KY
    KHURGIN, YI
    BULLETIN OF THE ACADEMY OF SCIENCES OF THE USSR DIVISION OF CHEMICAL SCIENCE, 1977, 26 (07): : 1373 - 1376
  • [39] QUANTUM-CHEMICAL STUDY OF ALLYLIC COMPOUNDS WITH 2 BONDED HEAVY-ATOMS
    PROMYSLOV, VM
    SHORYGIN, PP
    BULLETIN OF THE RUSSIAN ACADEMY OF SCIENCES-DIVISION OF CHEMICAL SCIENCE, 1992, 41 (03): : 500 - 503
  • [40] Quantum-chemical study of germanium-substituent bonds in tricoordinated germanium compounds
    Alekseev, N. V.
    Chernyshev, E. A.
    JOURNAL OF STRUCTURAL CHEMISTRY, 2008, 49 (05) : 828 - 836
12345