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ChemInform Abstract: 1,4-Diphosphabutadiyne: A Realistic Target for Synthesis? A Theoretical Investigation of C2P2, C2N2, [Cr(CO)5PCCP], and [(CO)5Cr(PCCP)Cr(CO)5].

✍ Scribed by F. Matthias Bickelhaupt; Friedrich Bickelhaupt

Publisher: John Wiley and Sons
Year: 2010
Weight: 34 KB
Volume: 30
Category: Article
ISSN: 0931-7597
DOI: 10.1002/chin.199921030

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1,4-Diphosphabutadiyne: A Realistic Targ

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To assess the viability of 1,4diphosphabutadiyne (PCCP, 2 a) as a target for synthesis, we have investigated C 2 P 2 isomers 2, the end-on complexes [Cr(CO) 5 PCCP] (3) and [(CO) 5 Cr-(PCCP)Cr(CO) 5 ] (4), as well as their side-on analogues 6 and 7, respectively, using nonlocal density functional th

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