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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Main Authors:	Abdul Manan, Mohd Abdul Fatah, M. Tahir, M. Ibrahim, Karen A., Crouse, Fiona N.-F., How, David J., Watkin
Format:	Article
Language:	English
Published:	Research Management Institute 2012
Subjects:	Carbon disulfide. Graphene. Carbon Dithiocarbamates. Thio compounds Crystallography Dimethyl sulfoxide
Online Access:	http://ir.uitm.edu.my/id/eprint/11111/ http://ir.uitm.edu.my/id/eprint/11111/1/AJ_MOHD%20ABDUL%20FATAH%20ABDUL%20MANAN%20SRJ%2012%201.pdf

id	uitm-11111
recordtype	eprints
spelling	uitm-111112016-05-16T09:06:08Z http://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.] 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 http://ir.uitm.edu.my/id/eprint/11111/1/AJ_MOHD%20ABDUL%20FATAH%20ABDUL%20MANAN%20SRJ%2012%201.pdf Abdul Manan, Mohd Abdul Fatah and M. Tahir, M. Ibrahim and Karen A., Crouse and Fiona N.-F., How and David J., Watkin (2012) A crystallographic study of Bis[S-benzyl-5-bromo- 2-oxoindolin-3- lidenemethanehydrazonthioate] disulfide solvated with dimethylsulfoxide / Mohd Abdul Fatah Abdul Manan ... [et al.]. Scientific Research Journal, 9 (2). pp. 87-100. ISSN 1675-7009
repository_type	Digital Repository
institution_category	Local University
institution	Universiti Teknologi MARA
building	UiTM Institutional Repository
collection	Online Access
language	English
topic	Carbon disulfide. Graphene. Carbon Dithiocarbamates. Thio compounds Crystallography Dimethyl sulfoxide
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.]
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.
format	Article
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
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_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_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_sort	crystallographic study of bis[s-benzyl-5-bromo- 2-oxoindolin-3- lidenemethanehydrazonthioate] disulfide solvated with dimethylsulfoxide / mohd abdul fatah abdul manan ... [et al.]
publisher	Research Management Institute
publishDate	2012
url	http://ir.uitm.edu.my/id/eprint/11111/ http://ir.uitm.edu.my/id/eprint/11111/1/AJ_MOHD%20ABDUL%20FATAH%20ABDUL%20MANAN%20SRJ%2012%201.pdf
first_indexed	2023-09-18T22:47:52Z
last_indexed	2023-09-18T22:47:52Z
_version_	1777417346052259840

A crystallographic study of Bis[S-benzyl-5-bromo- 2-oxoindolin-3- lidenemethanehydrazonthioate] disulfide solvated with dimethylsulfoxide / Mohd Abdul Fatah Abdul Manan ... [et al.]

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