Spectral studies of chemically generated C60n− and c70n− anions; n=1,2 and 3
✍ Scribed by D.V. Konarev; N.V. Drichko; V.N. Semkin; A. Graja
- Book ID
- 117542516
- Publisher
- Elsevier Science
- Year
- 1999
- Tongue
- English
- Weight
- 232 KB
- Volume
- 103
- Category
- Article
- ISSN
- 0379-6779
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We describe the HPLC separation and identification of N@C60 and N2@C60. These species were observed after eleven sequential HPLC separations. Their retention times are in the same range as those of the other noninteractive endohedral species of C60, such as noble gas endohedral C60. The separation f
Spin density distributions and isotropic hyperfine coupling constants of N@C 60 , P@C 60 , N@C 70 , N@C 60 (CH 2 ) 6 , and N@C 60 (SiH 2 ) 6 are theoretically investigated by testing B3LYP and MP2 methods for the free N and P atoms. When N is encapsulated inside C 60 , the calculated spin density at