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Structure of the alkali metal salts of hydroxycoumarins and hydroxyfurocoumarins and their MO LCAO calculation

โœ Scribed by M. E. Perel'son; Yu. N. Sheinker

Book ID
112363109
Publisher
Springer
Year
1971
Tongue
English
Weight
481 KB
Volume
4
Category
Article
ISSN
0040-5760

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๐Ÿ“œ SIMILAR VOLUMES

LCAO-MO-calculations on the enol form of
LCAO-MO-calculations on the enol form of acetylacetone and its metal complexes: LCAO-MO-studies on molecular structure III
โœ Peter Schuster ๐Ÿ“‚ Article ๐Ÿ“… 1969 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 295 KB

## Energy surfaces descrlbmg the motion of the hydrogen bonded proton or the metal atom m the en01 form of acetylacetone and its Li complex were calculated by a semtemptrical LCAO-MO-SCF procedure for all valence electrons (CNDO/B). CNDO/Z calculattons on the structure of the Be complex of aceeyl