Catena-poly[[diaquacalcium]bis-[μ-2-(1,3-dioxoisoindolin-2-yl)acetato] -κ 3 O,O′:O;κ 3O:O,O′]

Moazzam H. Bhatti, Uzma Yunus, Sohail Saeed, Syed Raza Shah, Wing Tak Wong

Research output: Journal article publicationJournal articleAcademic researchpeer-review

1 Citation (Scopus)

Abstract

In the title complex, [Ca(C 10H 6NO 4) 2(H 2O) 2] n , the Ca II atom lies on a twofold rotation axis and adopts a dodeca-hedral geometry. The Ca II atom is octa-coordinated by two O atoms from two water molecules and six O atoms from four acetate ligands. Each acetate acts as a tridentate ligand bridging two Ca II atoms, resulting in a chain running along the c axis. O - H⋯O and C - H⋯O hydrogen bonds connect the chains into a two-dimensional network parallel to [011]. π-π interactions between adjacent isoindoline-1,3-dione rings [centroid-centroid distance = 3.4096 (11) Å] further consolidate the structure. One of the carboxylate O atoms is disordered over two sites in a 0.879 (12):0.121 (12) ratio.
Original languageEnglish
JournalActa Crystallographica Section E: Structure Reports Online
Volume67
Issue number8
DOIs
Publication statusPublished - 1 Aug 2011
Externally publishedYes

Keywords

  • data-to-parameter ratio = 14.6
  • disorder in main residue
  • mean σ(CC) = 0.003 Å
  • R factor = 0.036
  • single-crystal X-ray study
  • T = 296 K
  • wR factor = 0.102

ASJC Scopus subject areas

  • Condensed Matter Physics
  • Materials Science(all)
  • Chemistry(all)

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