Density functional study of noncovalent catalysis of the Diels-Alder reaction 
by the neutral hydrogen bond donors thiourea and urea

Fu, A.; Thiel, W.

doi:10.1016/j.theochem.2006.02.020

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Density functional study of noncovalent catalysis of the Diels-Alder reaction by the neutral hydrogen bond donors thiourea and urea

Fu, A., & Thiel, W. (2006). Density functional study of noncovalent catalysis of the Diels-Alder reaction by the neutral hydrogen bond donors thiourea and urea. Journal of Molecular Structure-Theochem, 765, 45-52. doi:10.1016/j.theochem.2006.02.020.

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Item Permalink: https://hdl.handle.net/11858/00-001M-0000-000F-9309-8 Version Permalink: https://hdl.handle.net/11858/00-001M-0000-001A-322E-8

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Creators:
Fu, A.¹, Author
Thiel, W.¹, Author

Affiliations:
1Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society, ou_1445590

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Free keywords: Diels-Alder reaction; cyclopentadiene; methyl vinyl ketone; density functional calculations; hydrogen-bonding catalysts

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Language(s): eng - English

Dates: Date issued: 2006

Publication Status: Issued

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Rev. Type: Peer

Identifiers: eDoc: 299602
DOI: 10.1016/j.theochem.2006.02.020
ISI: 000239268900007

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Title: Journal of Molecular Structure-Theochem

Alternative Title : J. Mol. Struct.(THEOCHEM)

Source Genre: Journal

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Pages: - Volume / Issue: 765 Sequence Number: - Start / End Page: 45 - 52 Identifier: ISSN: 0166-1280