(4-Benzyl-2-oxo-1,3-oxazolidin-5-yl)methyl methanesulfonate
The title compound, C(12)H(15)NO(5)S, features an approximately planar five-membered oxazolidin ring (r.m.s. deviation = 0.045 angstrom) with the peripheral benzyl and methyl methanesulfonate residues lying to either side of the plane. In the crystal, N-H center dot center dot center dot O hydrogen...
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| Format: | Article |
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International Union of Crystallography
2010
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| _version_ | 1796946867013025792 |
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| author | Cunico, W. Gomes, C.R.B. Tiekink, E.R.T. Vellasco Junior, W.T. Wardell, J.L. Wardell, S.M.S.V. |
| author_facet | Cunico, W. Gomes, C.R.B. Tiekink, E.R.T. Vellasco Junior, W.T. Wardell, J.L. Wardell, S.M.S.V. |
| author_sort | Cunico, W. |
| collection | UM |
| description | The title compound, C(12)H(15)NO(5)S, features an approximately planar five-membered oxazolidin ring (r.m.s. deviation = 0.045 angstrom) with the peripheral benzyl and methyl methanesulfonate residues lying to either side of the plane. In the crystal, N-H center dot center dot center dot O hydrogen bonds, involving one of the sulfur-bound oxo groups as acceptor, lead to the formation of supramolecular chains along the b axis. These chains are reinforced by C-H center dot center dot center dot O contacts with the carbonyl O atom accepting three such interactions. The structure was refined as a racemic twin, with the major component being present 89% of the time. |
| first_indexed | 2024-03-06T05:38:18Z |
| format | Article |
| id | um.eprints-15213 |
| institution | Universiti Malaya |
| last_indexed | 2024-03-06T05:38:18Z |
| publishDate | 2010 |
| publisher | International Union of Crystallography |
| record_format | dspace |
| spelling | um.eprints-152132019-01-31T01:48:58Z http://eprints.um.edu.my/15213/ (4-Benzyl-2-oxo-1,3-oxazolidin-5-yl)methyl methanesulfonate Cunico, W. Gomes, C.R.B. Tiekink, E.R.T. Vellasco Junior, W.T. Wardell, J.L. Wardell, S.M.S.V. QC Physics The title compound, C(12)H(15)NO(5)S, features an approximately planar five-membered oxazolidin ring (r.m.s. deviation = 0.045 angstrom) with the peripheral benzyl and methyl methanesulfonate residues lying to either side of the plane. In the crystal, N-H center dot center dot center dot O hydrogen bonds, involving one of the sulfur-bound oxo groups as acceptor, lead to the formation of supramolecular chains along the b axis. These chains are reinforced by C-H center dot center dot center dot O contacts with the carbonyl O atom accepting three such interactions. The structure was refined as a racemic twin, with the major component being present 89% of the time. International Union of Crystallography 2010 Article PeerReviewed Cunico, W. and Gomes, C.R.B. and Tiekink, E.R.T. and Vellasco Junior, W.T. and Wardell, J.L. and Wardell, S.M.S.V. (2010) (4-Benzyl-2-oxo-1,3-oxazolidin-5-yl)methyl methanesulfonate. Acta Crystallographica Section E: Structure Reports Online, 66 (2). O267-U1594. ISSN 1600-5368, |
| spellingShingle | QC Physics Cunico, W. Gomes, C.R.B. Tiekink, E.R.T. Vellasco Junior, W.T. Wardell, J.L. Wardell, S.M.S.V. (4-Benzyl-2-oxo-1,3-oxazolidin-5-yl)methyl methanesulfonate |
| title | (4-Benzyl-2-oxo-1,3-oxazolidin-5-yl)methyl methanesulfonate |
| title_full | (4-Benzyl-2-oxo-1,3-oxazolidin-5-yl)methyl methanesulfonate |
| title_fullStr | (4-Benzyl-2-oxo-1,3-oxazolidin-5-yl)methyl methanesulfonate |
| title_full_unstemmed | (4-Benzyl-2-oxo-1,3-oxazolidin-5-yl)methyl methanesulfonate |
| title_short | (4-Benzyl-2-oxo-1,3-oxazolidin-5-yl)methyl methanesulfonate |
| title_sort | 4 benzyl 2 oxo 1 3 oxazolidin 5 yl methyl methanesulfonate |
| topic | QC Physics |
| work_keys_str_mv | AT cunicow 4benzyl2oxo13oxazolidin5ylmethylmethanesulfonate AT gomescrb 4benzyl2oxo13oxazolidin5ylmethylmethanesulfonate AT tiekinkert 4benzyl2oxo13oxazolidin5ylmethylmethanesulfonate AT vellascojuniorwt 4benzyl2oxo13oxazolidin5ylmethylmethanesulfonate AT wardelljl 4benzyl2oxo13oxazolidin5ylmethylmethanesulfonate AT wardellsmsv 4benzyl2oxo13oxazolidin5ylmethylmethanesulfonate |