Bis[(2,2-dimethylpropanoyloxy)methyl] {[2-(6-amino-9H-purin-9-yl)eth-oxy] methyl}phosphonate-succinic acid (2/1)
DC Field | Value | Language |
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dc.contributor.author | Jung, S. | - |
dc.contributor.author | Ha, J.-M. | - |
dc.contributor.author | Kim, I.W. | - |
dc.date.available | 2018-05-10T07:49:54Z | - |
dc.date.created | 2018-04-17 | - |
dc.date.issued | 2012 | - |
dc.identifier.issn | 1600-5368 | - |
dc.identifier.uri | http://scholarworks.bwise.kr/ssu/handle/2018.sw.ssu/13295 | - |
dc.description.abstract | The title compound, C 20H 32N 5O 8P·0.5C 4H 6O 4, is composed of two 9-{2-[bis-(pivaloyloxymeth-oxy)phosphinylmeth-oxy]eth-yl}adenine, commonly known as adefovir dipivoxil (AD), mol-ecules linked to the carb-oxy-lic acid groups of succinic acid (SA). The asymmetric unit contains one mol-ecule of AD and half a mol-ecule of SA, which sits on an inversion center. Both adenine units in the two AD mol-ecules make AD-SA N - H⋯O and SA-AD O - H⋯N hydrogen bonds to SA. In addition, the inter-molecular AD-AD N - H⋯O - P hydrogen bond serves to stabilize the cocrystal. There is also a π-π stacking inter-action [inter-planar spacing 3.34 (19) Å] between adjacent inversion-related adenine groups. | - |
dc.relation.isPartOf | Acta Crystallographica Section E: Structure Reports Online | - |
dc.title | Bis[(2,2-dimethylpropanoyloxy)methyl] {[2-(6-amino-9H-purin-9-yl)eth-oxy] methyl}phosphonate-succinic acid (2/1) | - |
dc.type | Article | - |
dc.identifier.doi | 10.1107/S1600536812006873 | - |
dc.type.rims | ART | - |
dc.identifier.bibliographicCitation | Acta Crystallographica Section E: Structure Reports Online, v.68, no.3, pp.o809 - o810 | - |
dc.description.journalClass | 1 | - |
dc.identifier.scopusid | 2-s2.0-84857954565 | - |
dc.citation.endPage | o810 | - |
dc.citation.number | 3 | - |
dc.citation.startPage | o809 | - |
dc.citation.title | Acta Crystallographica Section E: Structure Reports Online | - |
dc.citation.volume | 68 | - |
dc.contributor.affiliatedAuthor | Kim, I.W. | - |
dc.type.docType | Article | - |
dc.description.oadoiVersion | published | - |
dc.subject.keywordAuthor | data-to-parameter ratio = 17.3 | - |
dc.subject.keywordAuthor | mean σ(C-C) = 0.004 Å | - |
dc.subject.keywordAuthor | R factor = 0.046 | - |
dc.subject.keywordAuthor | single-crystal X-ray study | - |
dc.subject.keywordAuthor | T = 296 K | - |
dc.subject.keywordAuthor | wR factor = 0.143 | - |
dc.description.journalRegisteredClass | scie | - |
dc.description.journalRegisteredClass | scopus | - |
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