BIOMAT Database Logo BIOMAT Database Logo

1-Benzyl-4-(4-nitrophenyl)-2,3-dihydro-1H-1,5-benzodiazepine: a three-dimensional framework structure generated by two C-H...O hydrogen bonds and one C-H...pi(arene) hydrogen bond. 2005

Harlen Torres, and Braulio Insuasty, and Justo Cobo, and John N Low, and Christopher Glidewell
Grupo de Investigación de Compuestos Heterocíclicos, Departamento de Química, Universidad de Valle, AA 25360 Cali, Colombia.

In the title compound, C22H19N3O2, the seven-membered ring adopts a boat conformation. The molecules are linked by a combination of two C-H...O hydrogen bonds and one C-H...pi(arene) hydrogen bond into a complex three-dimensional framework structure; each individual hydrogen bond generates a one-dimensional substructure, and pairwise combinations of two hydrogen bonds generate a further set of three one-dimensional substructures.

UI MeSH Term Description Entries
D006860 Hydrogen Bonding A low-energy attractive force between hydrogen and another element. It plays a major role in determining the properties of water, proteins, and other compounds. Hydrogen Bonds,Bond, Hydrogen,Hydrogen Bond
D001569 Benzodiazepines A group of two-ring heterocyclic compounds consisting of a benzene ring fused to a diazepine ring. Benzodiazepine,Benzodiazepine Compounds
D013058 Mass Spectrometry An analytical method used in determining the identity of a chemical based on its mass using mass analyzers/mass spectrometers. Mass Spectroscopy,Spectrometry, Mass,Spectroscopy, Mass,Spectrum Analysis, Mass,Analysis, Mass Spectrum,Mass Spectrum Analysis,Analyses, Mass Spectrum,Mass Spectrum Analyses,Spectrum Analyses, Mass
D015394 Molecular Structure The location of the atoms, groups or ions relative to one another in a molecule, as well as the number, type and location of covalent bonds. Structure, Molecular,Molecular Structures,Structures, Molecular
D018360 Crystallography, X-Ray The study of crystal structure using X-RAY DIFFRACTION techniques. (McGraw-Hill Dictionary of Scientific and Technical Terms, 4th ed) X-Ray Crystallography,Crystallography, X Ray,Crystallography, Xray,X Ray Crystallography,Xray Crystallography,Crystallographies, X Ray,X Ray Crystallographies

Related Publications

Harlen Torres, and Braulio Insuasty, and Justo Cobo, and John N Low, and Christopher Glidewell
4-Nitrophenyl phenyl ether: sheets built from C-H...O and C-H...pi(arene) hydrogen bonds.
March 2005, Acta crystallographica. Section C, Crystal structure communications,
Harlen Torres, and Braulio Insuasty, and Justo Cobo, and John N Low, and Christopher Glidewell
O-phenyl (triphenylphosphoniomethyl)phosphonate phenol solvate: supramolecular structure generated by O-H...O, C-H...O and C-H...pi(arene) hydrogen bonds.
September 2007, Acta crystallographica. Section C, Crystal structure communications,
Harlen Torres, and Braulio Insuasty, and Justo Cobo, and John N Low, and Christopher Glidewell
Bis(4-nitrophenyl) disulfide at 150 K, a three-dimensional framework built from C-H...O hydrogen bonds and aromatic pi...pi stacking interactions
June 2000, Acta crystallographica. Section C, Crystal structure communications,
Harlen Torres, and Braulio Insuasty, and Justo Cobo, and John N Low, and Christopher Glidewell
1-(2-Aminophenyl)-3-(4-pyridyl)prop-2-en-1-one: a three-dimensional framework structure built from N-H...N, C-H...O and C-H...π(arene) hydrogen bonds.
December 2010, Acta crystallographica. Section C, Crystal structure communications,
Harlen Torres, and Braulio Insuasty, and Justo Cobo, and John N Low, and Christopher Glidewell
1-Benzyl-2,3-dihydro-quinolin-4(1H)-one.
January 2008, Acta crystallographica. Section E, Structure reports online,
Harlen Torres, and Braulio Insuasty, and Justo Cobo, and John N Low, and Christopher Glidewell
Naphthalene-1,6-diol: a three-dimensional framework built from O-H...O, O-H...pi and C-H...O hydrogen bonds.
July 2007, Acta crystallographica. Section C, Crystal structure communications,
Harlen Torres, and Braulio Insuasty, and Justo Cobo, and John N Low, and Christopher Glidewell
(2R*,4S*)-2-(pyridin-3-yl)-2,3,4,5-tetrahydro-1H-1-benzazepin-4-ol: a three-dimensional framework built from O-H···N, C-H···O and C-H···π(arene) hydrogen bonds.
May 2011, Acta crystallographica. Section C, Crystal structure communications,
Harlen Torres, and Braulio Insuasty, and Justo Cobo, and John N Low, and Christopher Glidewell
2,3-Bis[(4-methylphenyl)sulfanyl]-4H-1-benzothiopyran-4-one 1,1-dioxide forms a framework built from C-H...O, C-H...pi(arene) and pi-pi interactions.
May 2004, Acta crystallographica. Section C, Crystal structure communications,
Harlen Torres, and Braulio Insuasty, and Justo Cobo, and John N Low, and Christopher Glidewell
3-(5-Chloro-3-methyl-1-phenylpyrazol-4-yl)-1,5-diphenylpentane-1,5-dione: sheets built from C-H...O and C-H...pi(arene) hydrogen bonds.
August 2006, Acta crystallographica. Section C, Crystal structure communications,
Harlen Torres, and Braulio Insuasty, and Justo Cobo, and John N Low, and Christopher Glidewell
(4-nitrophenylsulfinyl)acetic acid, a three-dimensional hydrogen-bonded framework built from a combination of two-centre O-H...O and C-H...O hydrogen bonds and a three-centre C-H...(O)2 hydrogen bond.
March 2003, Acta crystallographica. Section C, Crystal structure communications,
Copied contents to your clipboard!