An overview of magnetic circular dichroism (MCD) spectroscopy of π‐electron systems derived from a 4
- Home
- Search Results
- Page 1 of 1
Search for: All records
-
Total Resources1
- Resource Type
-
00010
- Availability
-
10
- Author / Contributor
- Filter by Author / Creator
-
-
Casher, Deborah L. (1)
-
Chalupský, Jakub (1)
-
Fleischhauer, Joerg (1)
-
Komatsu, Koichi (1)
-
Michl, Josef (1)
-
Raabe, Gerhard (1)
-
Tsuji, Hayato (1)
-
Uto, Takayuki (1)
-
Wen, Jin (1)
-
Yanai, Takeshi (1)
-
#Tyler Phillips, Kenneth E. (0)
-
#Willis, Ciara (0)
-
& Abreu-Ramos, E. D. (0)
-
& Abramson, C. I. (0)
-
& Abreu-Ramos, E. D. (0)
-
& Adams, S.G. (0)
-
& Ahmed, K. (0)
-
& Ahmed, Khadija. (0)
-
& Akcil-Okan, O. (0)
-
& Akuom, D. (0)
-
- Filter by Editor
-
-
& Spizer, S. M. (0)
-
& . Spizer, S. (0)
-
& Ahn, J. (0)
-
& Bateiha, S. (0)
-
& Bosch, N. (0)
-
& Brennan K. (0)
-
& Brennan, K. (0)
-
& Chen, B. (0)
-
& Chen, Bodong (0)
-
& Drown, S. (0)
-
& Ferretti, F. (0)
-
& Higgins, A. (0)
-
& J. Peters (0)
-
& Kali, Y. (0)
-
& Ruiz-Arias, P.M. (0)
-
& S. Spitzer (0)
-
& Spitzer, S. (0)
-
& Spitzer, S.M. (0)
-
(submitted - in Review for IEEE ICASSP-2024) (0)
-
- (0)
-
-
Have feedback or suggestions for a way to improve these results?
!
Note: When clicking on a Digital Object Identifier (DOI) number, you will be taken to an external site maintained by the publisher.
Some full text articles may not yet be available without a charge during the embargo (administrative interval).
What is a DOI Number?
Some links on this page may take you to non-federal websites. Their policies may differ from this site.
-
Abstract N ‐electron perimeter is provided, with emphasis on the hypothetical parent cycloocta‐1,3,5,7‐tetraene ofD 8h symmetry (1 ) and itsD 4h symmetry derivatives. UV‐visible absorption and MCD spectra of2 , aD 4h symmetric cycloocta‐1,3,5,7‐tetraene planarized by the effect of 4 bicyclo[2.1.1]hexeno units fused to its 8‐membered ring, are reported and interpreted. The perimeter model is applied to obtain an understanding of the nature of electronic states in1 and2 and to predict general trends in the spectra. The electronic excitation patterns are found to be different in the antiaromaticD 8h and unaromaticD 4h species, and their states cannot be unequivocally correlated. The results of time‐dependent density functional theory and extended multistate complete active space second‐order perturbation theory (XMS‐CASPT2) computations agree with the algebraic perimeter model analysis and reproduce the spectra of2 well, including three of the four observed MCD signs of A and B terms.