Home / Publications / Supertetrahedral cubane C32H8 and supertetrahedral dodecahedrane C80H20 with tetrahedral C4H fragments in the vertices

Supertetrahedral cubane C32H8 and supertetrahedral dodecahedrane C80H20 with tetrahedral C4H fragments in the vertices

Ruslan Mikhailovich Minyaev 1
Ruslan Mikhailovich Minyaev
, 
Vladimir Isaakovich Minkin 1
Vladimir Isaakovich Minkin
10.1016/j.mencom.2013.05.002
Published 2013-05-08
Communication , Volume 23, Issue 3, 131-132
5
Share
Cite this
GOST
 | 
Cite this
GOST Copy
Minyaev R. M., Minkin V. I. Supertetrahedral cubane C32H8 and supertetrahedral dodecahedrane C80H20 with tetrahedral C4H fragments in the vertices // Mendeleev Communications. 2013. Vol. 23. No. 3. pp. 131-132.
GOST all authors (up to 50) Copy
Minyaev R. M., Minkin V. I. Supertetrahedral cubane C32H8 and supertetrahedral dodecahedrane C80H20 with tetrahedral C4H fragments in the vertices // Mendeleev Communications. 2013. Vol. 23. No. 3. pp. 131-132.
RIS
 | 
Cite this
RIS Copy
TY - JOUR
DO - 10.1016/j.mencom.2013.05.002
UR - https://mendcomm.colab.ws/publications/10.1016/j.mencom.2013.05.002
TI - Supertetrahedral cubane C32H8 and supertetrahedral dodecahedrane C80H20 with tetrahedral C4H fragments in the vertices
T2 - Mendeleev Communications
AU - Minyaev, Ruslan Mikhailovich
AU - Minkin, Vladimir Isaakovich
PY - 2013
DA - 2013/05/08
PB - Mendeleev Communications
SP - 131-132
IS - 3
VL - 23
ER -
BibTex
 | 
Cite this
BibTex (up to 50 authors) Copy
@article{2013_Minyaev,
author = {Ruslan Mikhailovich Minyaev and Vladimir Isaakovich Minkin},
title = {Supertetrahedral cubane C32H8 and supertetrahedral dodecahedrane C80H20 with tetrahedral C4H fragments in the vertices},
journal = {Mendeleev Communications},
year = {2013},
volume = {23},
publisher = {Mendeleev Communications},
month = {May},
url = {https://mendcomm.colab.ws/publications/10.1016/j.mencom.2013.05.002},
number = {3},
pages = {131--132},
doi = {10.1016/j.mencom.2013.05.002}
}
MLA
Cite this
MLA Copy
Minyaev, Ruslan Mikhailovich, and Vladimir Isaakovich Minkin. “Supertetrahedral cubane C32H8 and supertetrahedral dodecahedrane C80H20 with tetrahedral C4H fragments in the vertices.” Mendeleev Communications, vol. 23, no. 3, May. 2013, pp. 131-132. https://mendcomm.colab.ws/publications/10.1016/j.mencom.2013.05.002.

Abstract

The DFT B3LYP/6-311+G(d,p) calculations predict novel stable hydrocarbon cage structures of ‘supertetrahedral’ cubane C32H8 and dodecahedrane C80H20 in which the CH vertices are replaced by the tetrahedral C4H fragments.

References

2.
10.1016/j.mencom.2013.05.002_sbref0005b
Hopf
Classics in Hydrocarbon Chemistry, 2000
3.
Tetrakis(trimethylsilyl)tetrahedrane
Maier G., Neudert J., Wolf O., Pappusch D., Sekiguchi A., Tanaka M., Matsuo T.
Journal of the American Chemical Society, 2002
4.
The Cubane System
Eaton P.E., Cole T.W.
Journal of the American Chemical Society, 1964
5.
X-ray structure analysis of the pentagonal dodecahedrane hydrocarbon (CH)20
Gallucci J.C., Doecke C.W., Paquette L.A.
Journal of the American Chemical Society, 1986
7.
Chemical crystallography of fullerenes
Neretin I.S., Slovokhotov Y.L.
Russian Chemical Reviews, 2004
8.
Putting Helium Inside Dodecahedrane
Cross R.J., Saunders M., Prinzbach H.
Organic Letters, 1999
9.
The Energetics of Shooting Ions into the Dodecahedrane Cage
Mascal M.
Journal of Organic Chemistry, 2002
10.
Structures, Stabilities, and Ionization Potentials of Dodecahedrane Endohedral Complexes
Moran D., Stahl F., Jemmis E.D., Schaefer H.F., Schleyer P.V.
Journal of Physical Chemistry A, 2002
12.
10.1016/j.mencom.2013.05.002_bib0050
Minyaev
Izv. Akad. Nauk, Ser. Khim., 2012
13.
A. Sekiguchi, in Strained Hydrocarbons, ed. H. Dodziuk, Wiley-VCH Verlag, Weinheim, 2009, ch. 2.6.
14.
M. J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, J.A. Montgomery, Jr., T. Vreven, K.N. Kudin, J.C. Burant, J.M. Millam, S.S. Iyengar, J. Tomasi, V. Barone, B. Mennucci, M. Cossi, G. Scalmani, N. Rega, G.A. Petersson, H. Nakatsuji, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, M. Klene, X. Li, J.E. Knox, H.P. Hratchian, J.B. Cross, V. Bakken, C. Adamo, J. Jaramillo, R. Gomperts, R.E. Stratmann, O. Yazyev, A.J. Austin, R. Cammi, C. Pomelli, J.W. Ochterski, P.Y. Ayala, K. Morokuma, G.A. Voth, P. Salvador, J.J. Dannenberg, V.G. Zakrzewski, S. Dapprich, A.D. Daniels, M.C. Strain, O. Farkas, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J.V. Ortiz, Q. Cui, A.G. Baboul, S. Clifford, J. Cioslowski, B.B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, M. Challacombe, P.M. W. Gill, B. Johnson, W. Chen, M.W. Wong, C. Gonzalez and J. A. Pople, Gaussian 03, Revision E.01, Gaussian, Inc., Wallingford CT, 2004.
15.
Cubane. molecular structure determined by gas-phase electron diffraction
Almenningen A., Jonvik T., Martin H.D., Urbanek T.
Journal of Molecular Structure, 1985