Role of Steric Hindrance in the Crystal Packing of Z′ = 4 Superstructure of Trimethyltin Hydroxide

Handle URI:
http://hdl.handle.net/10754/627466
Title:
Role of Steric Hindrance in the Crystal Packing of Z′ = 4 Superstructure of Trimethyltin Hydroxide
Authors:
Dey, S.; Schönleber, A. ( 0000-0003-2516-2332 ) ; Mondal, S. ( 0000-0003-2633-3842 ) ; Ali, S. I.; van Smaalen, S. ( 0000-0001-9645-8240 )
Abstract:
The roomerature crystal structure of trimethyltin hydroxide, (CH)SnOH, has been described by Anderson et al. [Cryst. Growth Des. 2011, 11, 820-826] as a 2a × 2b × 8c, 32-fold superstructure. We report a a × b × 8c, eight-fold superstructure with orthorhombic P2cn symmetry and Z′ = 4. Structured diffuse scattering observed at the positions of presumed superlattice reflections along a∗ and b∗ might have appeared as Bragg reflections in the experiment by Anderson et al. Alternatively, Anderson et al. and the present work might have studied different polymorphs of (CH)SnOH. Crystalline (CH)SnOH constitutes polymeric chains arranged parallel to c. In the eight-fold superstructure at 220 K, the polymeric chains possess a distorted zigzag arrangement of linked linear O-Sn-O units with bent angle at oxygen of ∼139.2°. This structure is essentially different from the 8-helical arrangement in the published 32-fold superstructure model. The origin of the distorted zigzag structure is explained by steric hindrance between hydrogen atoms of adjacent hydroxy groups and (CH)Sn groups. Frustration in the packing of the chains is determined by steric hindrance between methyl groups of neighboring chains, which prevents the formation of interchain C-H···O hydrogen bonds.
KAUST Department:
King Abdullah University of Science and Technology (KAUST), Core Labs, Thuwal, 23955-6900, Saudi Arabia.
Citation:
Dey S, Schönleber A, Mondal S, Ali SI, van Smaalen S (2018) Role of Steric Hindrance in the Crystal Packing of Z′ = 4 Superstructure of Trimethyltin Hydroxide. Crystal Growth & Design 18: 1394–1400. Available: http://dx.doi.org/10.1021/acs.cgd.7b01295.
Publisher:
American Chemical Society (ACS)
Journal:
Crystal Growth & Design
Issue Date:
22-Jan-2018
DOI:
10.1021/acs.cgd.7b01295
Type:
Article
ISSN:
1528-7483; 1528-7505
Sponsors:
The authors thank Carsten Paulmann for assistance in the diffraction experiments at beamline F1 of Hasylab at DESY, Hamburg. The authors thank Karen Friese and Vaclav Petricek for useful discussions. Financial support has been obtained from the German Science Foundation (DFG) under grant number SCHO 830/3-1.
Additional Links:
https://pubs.acs.org/doi/10.1021/acs.cgd.7b01295
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Articles

Full metadata record

DC FieldValue Language
dc.contributor.authorDey, S.en
dc.contributor.authorSchönleber, A.en
dc.contributor.authorMondal, S.en
dc.contributor.authorAli, S. I.en
dc.contributor.authorvan Smaalen, S.en
dc.date.accessioned2018-04-15T07:13:36Z-
dc.date.available2018-04-15T07:13:36Z-
dc.date.issued2018-01-22en
dc.identifier.citationDey S, Schönleber A, Mondal S, Ali SI, van Smaalen S (2018) Role of Steric Hindrance in the Crystal Packing of Z′ = 4 Superstructure of Trimethyltin Hydroxide. Crystal Growth & Design 18: 1394–1400. Available: http://dx.doi.org/10.1021/acs.cgd.7b01295.en
dc.identifier.issn1528-7483en
dc.identifier.issn1528-7505en
dc.identifier.doi10.1021/acs.cgd.7b01295en
dc.identifier.urihttp://hdl.handle.net/10754/627466-
dc.description.abstractThe roomerature crystal structure of trimethyltin hydroxide, (CH)SnOH, has been described by Anderson et al. [Cryst. Growth Des. 2011, 11, 820-826] as a 2a × 2b × 8c, 32-fold superstructure. We report a a × b × 8c, eight-fold superstructure with orthorhombic P2cn symmetry and Z′ = 4. Structured diffuse scattering observed at the positions of presumed superlattice reflections along a∗ and b∗ might have appeared as Bragg reflections in the experiment by Anderson et al. Alternatively, Anderson et al. and the present work might have studied different polymorphs of (CH)SnOH. Crystalline (CH)SnOH constitutes polymeric chains arranged parallel to c. In the eight-fold superstructure at 220 K, the polymeric chains possess a distorted zigzag arrangement of linked linear O-Sn-O units with bent angle at oxygen of ∼139.2°. This structure is essentially different from the 8-helical arrangement in the published 32-fold superstructure model. The origin of the distorted zigzag structure is explained by steric hindrance between hydrogen atoms of adjacent hydroxy groups and (CH)Sn groups. Frustration in the packing of the chains is determined by steric hindrance between methyl groups of neighboring chains, which prevents the formation of interchain C-H···O hydrogen bonds.en
dc.description.sponsorshipThe authors thank Carsten Paulmann for assistance in the diffraction experiments at beamline F1 of Hasylab at DESY, Hamburg. The authors thank Karen Friese and Vaclav Petricek for useful discussions. Financial support has been obtained from the German Science Foundation (DFG) under grant number SCHO 830/3-1.en
dc.publisherAmerican Chemical Society (ACS)en
dc.relation.urlhttps://pubs.acs.org/doi/10.1021/acs.cgd.7b01295en
dc.titleRole of Steric Hindrance in the Crystal Packing of Z′ = 4 Superstructure of Trimethyltin Hydroxideen
dc.typeArticleen
dc.contributor.departmentKing Abdullah University of Science and Technology (KAUST), Core Labs, Thuwal, 23955-6900, Saudi Arabia.en
dc.identifier.journalCrystal Growth & Designen
dc.contributor.institutionLaboratory of Crystallography, University of Bayreuth, 95440 Bayreuth, Germanyen
dc.contributor.institutionCSIR-Central Glass and Ceramic Research Institute, Kolkata - 700032, Indiaen
dc.contributor.institutionDepartment of Chemistry, Moyna College, Vidyasagar University, Anandapur-721629, Indiaen
kaust.authorDey, S.en
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