/ Home
/ SUBMISSION

/ The BJOC
/ Diamond Open Access
/ Journal Statistics
/ Editorial Board
/ Community
/ Call for papers

/ Latest Articles
/ Most accessed
/ Thematic issues
/ Volumes
/ Authors

/ Alerts

/ TWITTER
/ LINKEDIN
/ Mastodon
/ RSS FEED

Empty search

Article Type

Publication Date Range

Search Tips

This search combines search strings from the content search (i.e. "Full Text", "Author", "Title", "Abstract", or "Keywords") with "Article Type" and "Publication Date Range" using the AND operator.

Search Examples

aromatic	the word “aromatic”
aromatic aldehyde	the word “aromatic” OR “aldehyde”
+aromatic +aldehyde	both words “aromatic” AND “aldehyde”
+aromatic -aldehyde	the word “aromatic” but NOT “aldehyde”
“aromatic aldehyde”	the exact phrase “aromatic aldehyde”
benz*	words which begin with “benz”, such as “benzene” or “benzyl”
benz*yl	words that begin with “benz” and end with “yl”, such as “benzyl” or “benzoyl”
benzyl~	words that are close to the word “benzyl”, such as “benzoyl” (i.e., fuzzy search)

BROWSE
Latest Articles
Most accessed
thematic issues
volumes
authors

BROWSE

Latest Articles Most Accessed Thematic Issues Volumes Authors

Author

1 article(s) from Fabian, Walter M F

A computational study of base-catalyzed reactions of cyclic 1,2-diones: cyclobutane-1,2-dione

Nargis Sultana and
Walter M. F. Fabian

Beilstein J. Org. Chem. 2013, 9, 594–601, doi:10.3762/bjoc.9.64

PDF

Graphical Abstract

Scheme 1: Reactions of 1,2-dicarbonyl compounds with base.

Jump to Scheme 1

Scheme 2: Reactions of cyclic 1,2-diones with base.

Jump to Scheme 2

Scheme 3: Possible intermediates, transition structures, and products considered for the reaction of cyclobut...

Jump to Scheme 3

Figure 1: CEPA-1/def2-QZVPP calculated reaction paths for the reaction of 1·(H₂O)₂ + [OH(H₂O)₄]^–.

Jump to Figure 1

Figure 2: M06-2X/6-31+G(d,p) calculated structures of stationary points along the benzilic acid type rearrang...

Jump to Figure 2

Scheme 4: Reaction sequence calculated for an extended conformation of Int2.

Jump to Scheme 4

Figure 3: Calculated structure of transition state TS3a. Distances are given in angstrom (Å), angles in degre...

Jump to Figure 3

Figure 4: Calculated structures of pertinent stationary points along path C. Distances are given in angstroms...

Jump to Figure 4

Scheme 5: Actual path C obtained by the calculations (as in Scheme 3, Int1, TS4, Int4, and TS5 are hydrated by six wa...

Jump to Scheme 5

Album

Supp Info

Full Research Paper

Published 21 Mar 2013

Full text

Other Beilstein-Institut Open Science Activities

/ Help / Support & Contact / Alerts / Privacy Policy / Terms & Conditions / Impressum