ELECTRONIC-STRUCTURE OF THE 1,3-DIPHOSPHETANE

Schoeller W, GOETTE B, TUBBESING U (1995)
JOURNAL OF PHYSICAL ORGANIC CHEMISTRY 8(11): 742-746.

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Zeitschriftenaufsatz | Veröffentlicht | Englisch
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Abstract / Bemerkung
The equilibrium structures of cis- and trans-1,3-diphosphetane were evaluated at the RHF/6-31 g** level of optimization, with MP2 electron correlation correction. Both structures are puckered, the trans isomer being slightly lower in energy than the cis isomer. The inversion barrier in 1,3-diphosphetane is lower in energy than in phosphetane.
Erscheinungsjahr
Zeitschriftentitel
JOURNAL OF PHYSICAL ORGANIC CHEMISTRY
Band
8
Zeitschriftennummer
11
Seite
742-746
ISSN
eISSN
PUB-ID

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Schoeller W, GOETTE B, TUBBESING U. ELECTRONIC-STRUCTURE OF THE 1,3-DIPHOSPHETANE. JOURNAL OF PHYSICAL ORGANIC CHEMISTRY. 1995;8(11):742-746.
Schoeller, W., GOETTE, B., & TUBBESING, U. (1995). ELECTRONIC-STRUCTURE OF THE 1,3-DIPHOSPHETANE. JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 8(11), 742-746. doi:10.1002/poc.610081107
Schoeller, W., GOETTE, B., and TUBBESING, U. (1995). ELECTRONIC-STRUCTURE OF THE 1,3-DIPHOSPHETANE. JOURNAL OF PHYSICAL ORGANIC CHEMISTRY 8, 742-746.
Schoeller, W., GOETTE, B., & TUBBESING, U., 1995. ELECTRONIC-STRUCTURE OF THE 1,3-DIPHOSPHETANE. JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 8(11), p 742-746.
W. Schoeller, B. GOETTE, and U. TUBBESING, “ELECTRONIC-STRUCTURE OF THE 1,3-DIPHOSPHETANE”, JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, vol. 8, 1995, pp. 742-746.
Schoeller, W., GOETTE, B., TUBBESING, U.: ELECTRONIC-STRUCTURE OF THE 1,3-DIPHOSPHETANE. JOURNAL OF PHYSICAL ORGANIC CHEMISTRY. 8, 742-746 (1995).
Schoeller, Wolfgang, GOETTE, B, and TUBBESING, U. “ELECTRONIC-STRUCTURE OF THE 1,3-DIPHOSPHETANE”. JOURNAL OF PHYSICAL ORGANIC CHEMISTRY 8.11 (1995): 742-746.