A crystallographic study of Bis[S-benzyl-5-bromo- 2-oxoindolin-3- lidenemethanehydrazonthioate] disulfide solvated with dimethylsulfoxide / Mohd Abdul Fatah Abdul Manan ... [et al.]
The crystal structure of the title compound has been determined. The compound crystallized in the triclinic space group P -1, Z = 2, V = 1839.42(18) Å3 and unit cell parameters a = 11.0460(6) Å, b = 13.3180(7) Å, c = 13.7321(8) Å, α = 80.659(3)°, β = 69.800(3)° and γ = 77.007(2)° with one disordered...
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| Format: | Article |
| Language: | English |
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Research Management Institute
2012
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| Online Access: | https://ir.uitm.edu.my/id/eprint/11111/1/AJ_MOHD%20ABDUL%20FATAH%20ABDUL%20MANAN%20SRJ%2012%201.pdf |
| _version_ | 1796899642083901440 |
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| author | Abdul Manan, Mohd Abdul Fatah M. Tahir, M. Ibrahim Karen A., Crouse Fiona N.-F., How David J., Watkin |
| author_facet | Abdul Manan, Mohd Abdul Fatah M. Tahir, M. Ibrahim Karen A., Crouse Fiona N.-F., How David J., Watkin |
| author_sort | Abdul Manan, Mohd Abdul Fatah |
| collection | UITM |
| description | The crystal structure of the title compound has been determined. The compound crystallized in the triclinic space group P -1, Z = 2, V = 1839.42(18) Å3 and unit cell parameters a = 11.0460(6) Å, b = 13.3180(7) Å, c = 13.7321(8) Å, α = 80.659(3)°, β = 69.800(3)° and γ = 77.007(2)° with one disordered dimethylsulfoxide solvent molecule with the sulfur and oxygen atoms are distributed over two sites; S101/S102 [site occupancy factors: 0.6035/0.3965] and O130/O131 [site occupancy factor 0.3965/0.6035]. The C22-S21 and C19-S20 bond distances of 1.779(7) Å and 1.788(8) Å indicate that both of the molecules are connected by the disulfide bond [S20-S21 2.055(2) Å] in its thiol form. The crystal structure reveals that both of the 5-bromoisatin moieties are trans with respect to the [S21-S20 and
C19-N18] and [S20-S21 and C22-N23] bonds whereas the benzyl group from the dithiocarbazate are in the cis configuration with respect to [S21-S20 and C19-S44] and [S20- S21 and C22-S36] bonds. The crystal structure is further stabilized by intermolecular hydrogen bonds of N9-H35⋅⋅⋅O16 formed between the two molecules and N28-H281⋅⋅⋅O130, N28-H281⋅⋅⋅O131 and C41-H411⋅⋅⋅O131 with the solvent molecule. |
| first_indexed | 2024-03-06T01:23:57Z |
| format | Article |
| id | oai:ir.uitm.edu.my:11111 |
| institution | Universiti Teknologi MARA |
| language | English |
| last_indexed | 2024-03-06T01:23:57Z |
| publishDate | 2012 |
| publisher | Research Management Institute |
| record_format | dspace |
| spelling | oai:ir.uitm.edu.my:111112016-05-16T09:06:08Z https://ir.uitm.edu.my/id/eprint/11111/ A crystallographic study of Bis[S-benzyl-5-bromo- 2-oxoindolin-3- lidenemethanehydrazonthioate] disulfide solvated with dimethylsulfoxide / Mohd Abdul Fatah Abdul Manan ... [et al.] srj Abdul Manan, Mohd Abdul Fatah M. Tahir, M. Ibrahim Karen A., Crouse Fiona N.-F., How David J., Watkin Carbon disulfide. Graphene. Carbon Dithiocarbamates. Thio compounds Crystallography Dimethyl sulfoxide The crystal structure of the title compound has been determined. The compound crystallized in the triclinic space group P -1, Z = 2, V = 1839.42(18) Å3 and unit cell parameters a = 11.0460(6) Å, b = 13.3180(7) Å, c = 13.7321(8) Å, α = 80.659(3)°, β = 69.800(3)° and γ = 77.007(2)° with one disordered dimethylsulfoxide solvent molecule with the sulfur and oxygen atoms are distributed over two sites; S101/S102 [site occupancy factors: 0.6035/0.3965] and O130/O131 [site occupancy factor 0.3965/0.6035]. The C22-S21 and C19-S20 bond distances of 1.779(7) Å and 1.788(8) Å indicate that both of the molecules are connected by the disulfide bond [S20-S21 2.055(2) Å] in its thiol form. The crystal structure reveals that both of the 5-bromoisatin moieties are trans with respect to the [S21-S20 and C19-N18] and [S20-S21 and C22-N23] bonds whereas the benzyl group from the dithiocarbazate are in the cis configuration with respect to [S21-S20 and C19-S44] and [S20- S21 and C22-S36] bonds. The crystal structure is further stabilized by intermolecular hydrogen bonds of N9-H35⋅⋅⋅O16 formed between the two molecules and N28-H281⋅⋅⋅O130, N28-H281⋅⋅⋅O131 and C41-H411⋅⋅⋅O131 with the solvent molecule. Research Management Institute 2012 Article PeerReviewed text en https://ir.uitm.edu.my/id/eprint/11111/1/AJ_MOHD%20ABDUL%20FATAH%20ABDUL%20MANAN%20SRJ%2012%201.pdf A crystallographic study of Bis[S-benzyl-5-bromo- 2-oxoindolin-3- lidenemethanehydrazonthioate] disulfide solvated with dimethylsulfoxide / Mohd Abdul Fatah Abdul Manan ... [et al.]. (2012) Scientific Research Journal <https://ir.uitm.edu.my/view/publication/Scientific_Research_Journal/>, 9 (2). pp. 87-100. ISSN 1675-7009 https://srj.uitm.edu.my/ |
| spellingShingle | Carbon disulfide. Graphene. Carbon Dithiocarbamates. Thio compounds Crystallography Dimethyl sulfoxide Abdul Manan, Mohd Abdul Fatah M. Tahir, M. Ibrahim Karen A., Crouse Fiona N.-F., How David J., Watkin A crystallographic study of Bis[S-benzyl-5-bromo- 2-oxoindolin-3- lidenemethanehydrazonthioate] disulfide solvated with dimethylsulfoxide / Mohd Abdul Fatah Abdul Manan ... [et al.] |
| title | A crystallographic study of Bis[S-benzyl-5-bromo- 2-oxoindolin-3- lidenemethanehydrazonthioate] disulfide solvated with dimethylsulfoxide / Mohd Abdul Fatah Abdul Manan ... [et al.] |
| title_full | A crystallographic study of Bis[S-benzyl-5-bromo- 2-oxoindolin-3- lidenemethanehydrazonthioate] disulfide solvated with dimethylsulfoxide / Mohd Abdul Fatah Abdul Manan ... [et al.] |
| title_fullStr | A crystallographic study of Bis[S-benzyl-5-bromo- 2-oxoindolin-3- lidenemethanehydrazonthioate] disulfide solvated with dimethylsulfoxide / Mohd Abdul Fatah Abdul Manan ... [et al.] |
| title_full_unstemmed | A crystallographic study of Bis[S-benzyl-5-bromo- 2-oxoindolin-3- lidenemethanehydrazonthioate] disulfide solvated with dimethylsulfoxide / Mohd Abdul Fatah Abdul Manan ... [et al.] |
| title_short | A crystallographic study of Bis[S-benzyl-5-bromo- 2-oxoindolin-3- lidenemethanehydrazonthioate] disulfide solvated with dimethylsulfoxide / Mohd Abdul Fatah Abdul Manan ... [et al.] |
| title_sort | crystallographic study of bis s benzyl 5 bromo 2 oxoindolin 3 lidenemethanehydrazonthioate disulfide solvated with dimethylsulfoxide mohd abdul fatah abdul manan et al |
| topic | Carbon disulfide. Graphene. Carbon Dithiocarbamates. Thio compounds Crystallography Dimethyl sulfoxide |
| url | https://ir.uitm.edu.my/id/eprint/11111/1/AJ_MOHD%20ABDUL%20FATAH%20ABDUL%20MANAN%20SRJ%2012%201.pdf |
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