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N-(4-Methyl-piperazin-4-ium-1-yl)dithio-carbamate sesquihydrate.

Mietlarek-Kropidłowska A, Chojnacki J, Wityk P, Wieczór M, Becker B - Acta Crystallogr Sect E Struct Rep Online (2012)

Bottom Line: In the crystal structure of the title compound, C(6)H(13)N(3)S(2)·1.5H(2)O, weak N-H⋯S inter-actions between the zwitterionic mol-ecules are observed, leading to an extensively folded layered arrangement parallel to (100).There are three crystallographically independent water mol-ecules in the asymmetric unit, which are disordered and only half occupied.

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Affiliation: Department of Inorganic Chemistry, Chemical Faculty, Gdansk University of Technology, 11/12 G. Narutowicza Str., 80-233 Gdańsk, Poland.

ABSTRACT
In the crystal structure of the title compound, C(6)H(13)N(3)S(2)·1.5H(2)O, weak N-H⋯S inter-actions between the zwitterionic mol-ecules are observed, leading to an extensively folded layered arrangement parallel to (100). There are three crystallographically independent water mol-ecules in the asymmetric unit, which are disordered and only half occupied.

No MeSH data available.


Hydrogen bond network within the crystal of C6N3H13S2×1.5H2O. Dashed lines denote the assumed N—H···S hydrogen bonds. Water molecules are omitted for clarity. [Symmetry codes: (i) 1/2-x, 1.5-y, 2-z; (ii) x, 1-y, -1/2+z); (iii) x, 1-y, 1/2+z.]
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Fap2: Hydrogen bond network within the crystal of C6N3H13S2×1.5H2O. Dashed lines denote the assumed N—H···S hydrogen bonds. Water molecules are omitted for clarity. [Symmetry codes: (i) 1/2-x, 1.5-y, 2-z; (ii) x, 1-y, -1/2+z); (iii) x, 1-y, 1/2+z.]


N-(4-Methyl-piperazin-4-ium-1-yl)dithio-carbamate sesquihydrate.

Mietlarek-Kropidłowska A, Chojnacki J, Wityk P, Wieczór M, Becker B - Acta Crystallogr Sect E Struct Rep Online (2012)

Hydrogen bond network within the crystal of C6N3H13S2×1.5H2O. Dashed lines denote the assumed N—H···S hydrogen bonds. Water molecules are omitted for clarity. [Symmetry codes: (i) 1/2-x, 1.5-y, 2-z; (ii) x, 1-y, -1/2+z); (iii) x, 1-y, 1/2+z.]
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC3379308&req=5

Fap2: Hydrogen bond network within the crystal of C6N3H13S2×1.5H2O. Dashed lines denote the assumed N—H···S hydrogen bonds. Water molecules are omitted for clarity. [Symmetry codes: (i) 1/2-x, 1.5-y, 2-z; (ii) x, 1-y, -1/2+z); (iii) x, 1-y, 1/2+z.]
Bottom Line: In the crystal structure of the title compound, C(6)H(13)N(3)S(2)·1.5H(2)O, weak N-H⋯S inter-actions between the zwitterionic mol-ecules are observed, leading to an extensively folded layered arrangement parallel to (100).There are three crystallographically independent water mol-ecules in the asymmetric unit, which are disordered and only half occupied.

View Article: PubMed Central - HTML - PubMed

Affiliation: Department of Inorganic Chemistry, Chemical Faculty, Gdansk University of Technology, 11/12 G. Narutowicza Str., 80-233 Gdańsk, Poland.

ABSTRACT
In the crystal structure of the title compound, C(6)H(13)N(3)S(2)·1.5H(2)O, weak N-H⋯S inter-actions between the zwitterionic mol-ecules are observed, leading to an extensively folded layered arrangement parallel to (100). There are three crystallographically independent water mol-ecules in the asymmetric unit, which are disordered and only half occupied.

No MeSH data available.