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Article: Catena-poly[[diaquacalcium]bis-[μ-2-(1,3-dioxoisoindolin-2-yl)acetato] -κ 3 O,O′:O;κ 3O:O,O′]
Title | Catena-poly[[diaquacalcium]bis-[μ-2-(1,3-dioxoisoindolin-2-yl)acetato] -κ 3 O,O′:O;κ 3O:O,O′] |
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Authors | |
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 |
Issue Date | 2011 |
Publisher | International Union of Crystallography. The Journal's web site is located at http://journals.iucr.org/e/journalhomepage.html |
Citation | Acta Crystallographica Section E: Structure Reports Online, 2011, v. 67 n. 8, p. m1102-m1103 How to Cite? |
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. |
Persistent Identifier | http://hdl.handle.net/10722/159327 |
ISSN | 2011 Impact Factor: 0.347 |
PubMed Central ID | |
ISI Accession Number ID | |
References |
DC Field | Value | Language |
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dc.contributor.author | Bhatti, MH | en_HK |
dc.contributor.author | Yunus, U | en_HK |
dc.contributor.author | Saeed, S | en_HK |
dc.contributor.author | Shah, SR | en_HK |
dc.contributor.author | Wong, WT | en_HK |
dc.date.accessioned | 2012-08-16T05:48:41Z | - |
dc.date.available | 2012-08-16T05:48:41Z | - |
dc.date.issued | 2011 | en_HK |
dc.identifier.citation | Acta Crystallographica Section E: Structure Reports Online, 2011, v. 67 n. 8, p. m1102-m1103 | en_HK |
dc.identifier.issn | 1600-5368 | en_HK |
dc.identifier.uri | http://hdl.handle.net/10722/159327 | - |
dc.description.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. | en_HK |
dc.language | eng | en_US |
dc.publisher | International Union of Crystallography. The Journal's web site is located at http://journals.iucr.org/e/journalhomepage.html | en_HK |
dc.relation.ispartof | Acta Crystallographica Section E: Structure Reports Online | en_HK |
dc.rights | The definitive version is available at www.blackwell-synergy.com | - |
dc.rights | This work is licensed under a Creative Commons Attribution-NonCommercial-NoDerivatives 4.0 International License. | - |
dc.subject | data-to-parameter ratio = 14.6 | en_HK |
dc.subject | disorder in main residue | en_HK |
dc.subject | mean σ(CC) = 0.003 Å | en_HK |
dc.subject | R factor = 0.036 | en_HK |
dc.subject | single-crystal X-ray study | en_HK |
dc.subject | T = 296 K | en_HK |
dc.subject | wR factor = 0.102 | en_HK |
dc.title | Catena-poly[[diaquacalcium]bis-[μ-2-(1,3-dioxoisoindolin-2-yl)acetato] -κ 3 O,O′:O;κ 3O:O,O′] | en_HK |
dc.type | Article | en_HK |
dc.identifier.email | Wong, WT: wtwong@hku.hk | en_HK |
dc.identifier.authority | Wong, WT=rp00811 | en_HK |
dc.description.nature | published_or_final_version | - |
dc.identifier.doi | 10.1107/S1600536811027851 | en_HK |
dc.identifier.pmid | 22090875 | - |
dc.identifier.pmcid | PMC3212173 | - |
dc.identifier.scopus | eid_2-s2.0-80051533183 | en_HK |
dc.identifier.hkuros | 203948 | en_US |
dc.relation.references | http://www.scopus.com/mlt/select.url?eid=2-s2.0-80051533183&selection=ref&src=s&origin=recordpage | en_HK |
dc.identifier.volume | 67 | en_HK |
dc.identifier.issue | 8 | en_HK |
dc.identifier.spage | m1102 | en_HK |
dc.identifier.epage | m1103 | en_HK |
dc.identifier.isi | WOS:000294613900069 | - |
dc.publisher.place | United States | en_HK |
dc.identifier.scopusauthorid | Bhatti, MH=7103035366 | en_HK |
dc.identifier.scopusauthorid | Yunus, U=20736136900 | en_HK |
dc.identifier.scopusauthorid | Saeed, S=24462120400 | en_HK |
dc.identifier.scopusauthorid | Shah, SR=46461846800 | en_HK |
dc.identifier.scopusauthorid | Wong, WT=7403973084 | en_HK |
dc.identifier.citeulike | 9569790 | - |
dc.identifier.issnl | 1600-5368 | - |