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(E)-Methyl 3-(2-nitro-benzyl-idene)dithio-carbazate.

Shan S, Tian YL, Wang WL, Wang SH - Acta Crystallogr Sect E Struct Rep Online (2007)

Bottom Line: In both mol-ecules, the nitro group is tilted with respect to the aromatic ring [dihedral angles 32.0 (1)° in mol-ecule A and 34.0 (1)° in mol-ecule B].The dithio-carbazate unit is nearly coplanar with the aromatic ring in both mol-ecules.For mol-ecule B, pairs of mol-ecules are linked by N-H⋯O and C-H⋯O hydrogen bonds about a centre of symmetry to form a dimer, whereas mol-ecules A are not involved in hydrogen bonding in the crystal structure.

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Affiliation: College of Chemical Engineering and Materials Science, Zhejiang University of Technology, People's Republic of China.

ABSTRACT
The asymmetric unit of the title compound, C(9)H(9)N(3)O(2)S(2), contains two independent mol-ecules, A and B, with similar bond dimensions. In both mol-ecules, the nitro group is tilted with respect to the aromatic ring [dihedral angles 32.0 (1)° in mol-ecule A and 34.0 (1)° in mol-ecule B]. The dithio-carbazate unit is nearly coplanar with the aromatic ring in both mol-ecules. For mol-ecule B, pairs of mol-ecules are linked by N-H⋯O and C-H⋯O hydrogen bonds about a centre of symmetry to form a dimer, whereas mol-ecules A are not involved in hydrogen bonding in the crystal structure.

No MeSH data available.


The molecular structure of the title compound with 40% probability displacement ellipsoids (arbitrary spheres for H atoms).
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Related In: Results  -  Collection

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getmorefigures.php?uid=PMC2915011&req=5

Fap1: The molecular structure of the title compound with 40% probability displacement ellipsoids (arbitrary spheres for H atoms).


(E)-Methyl 3-(2-nitro-benzyl-idene)dithio-carbazate.

Shan S, Tian YL, Wang WL, Wang SH - Acta Crystallogr Sect E Struct Rep Online (2007)

The molecular structure of the title compound with 40% probability displacement ellipsoids (arbitrary spheres for H atoms).
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC2915011&req=5

Fap1: The molecular structure of the title compound with 40% probability displacement ellipsoids (arbitrary spheres for H atoms).
Bottom Line: In both mol-ecules, the nitro group is tilted with respect to the aromatic ring [dihedral angles 32.0 (1)° in mol-ecule A and 34.0 (1)° in mol-ecule B].The dithio-carbazate unit is nearly coplanar with the aromatic ring in both mol-ecules.For mol-ecule B, pairs of mol-ecules are linked by N-H⋯O and C-H⋯O hydrogen bonds about a centre of symmetry to form a dimer, whereas mol-ecules A are not involved in hydrogen bonding in the crystal structure.

View Article: PubMed Central - HTML - PubMed

Affiliation: College of Chemical Engineering and Materials Science, Zhejiang University of Technology, People's Republic of China.

ABSTRACT
The asymmetric unit of the title compound, C(9)H(9)N(3)O(2)S(2), contains two independent mol-ecules, A and B, with similar bond dimensions. In both mol-ecules, the nitro group is tilted with respect to the aromatic ring [dihedral angles 32.0 (1)° in mol-ecule A and 34.0 (1)° in mol-ecule B]. The dithio-carbazate unit is nearly coplanar with the aromatic ring in both mol-ecules. For mol-ecule B, pairs of mol-ecules are linked by N-H⋯O and C-H⋯O hydrogen bonds about a centre of symmetry to form a dimer, whereas mol-ecules A are not involved in hydrogen bonding in the crystal structure.

No MeSH data available.