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Updated: May 18, 2026

Preparation of N-(2-alkoxyvinyl)sulfonamides from N-tosyl-1,2,3-triazoles and Subsequent Conversion to Substituted Phthalans and Phenethylamines
Published on: January 3, 2018
N-(2-Methyl-phen-yl)-4-nitro-benzene-sulfonamide
This study characterizes a novel organic compound, C(13)H(12)N(2)O(4)S, detailing its molecular structure and crystal packing. The research reveals a significant dihedral angle between ring planes and specific hydrogen bonding interactions in its solid state.
Area of Science:
- Crystallography
- Organic Chemistry
- Molecular Structure Analysis
Background:
- Understanding the three-dimensional arrangement of atoms in organic molecules is crucial for predicting their properties and reactivity.
- Crystal engineering utilizes intermolecular forces, such as hydrogen bonds, to design materials with desired characteristics.
Purpose of the Study:
- To elucidate the crystal structure and molecular geometry of the title compound, C(13)H(12)N(2)O(4)S.
- To investigate the intermolecular interactions governing the crystal packing.
Main Methods:
- Single-crystal X-ray diffraction was employed to determine the molecular and crystal structure.
- Analysis of bond lengths, bond angles, and dihedral angles provided detailed geometric information.
- Hydrogen bond analysis identified the specific interactions present in the crystal lattice.
Main Results:
- The crystal structure of C(13)H(12)N(2)O(4)S was determined.
- A dihedral angle of 51.11(10)° was observed between the planes of the two ring systems within the molecule.
- Molecules were found to form inversion dimers through N-H⋯O(S) hydrogen bonds in the crystal.
Conclusions:
- The study provides a detailed structural description of the title compound.
- The observed dihedral angle and hydrogen bonding pattern offer insights into the molecule's conformation and solid-state behavior.
- This structural information can serve as a basis for further studies on related compounds or applications.
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