scholarly journals Crystal structure of 2-azido-1H-imidazole-4,5-dicarbonitrile

2015 ◽  
Vol 71 (9) ◽  
pp. o633-o633 ◽  
Author(s):  
G. Kenneth Windler ◽  
Brian L. Scott ◽  
Neil C. Tomson ◽  
Philip W. Leonard
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bond ◽  
Title Compound ◽  
Central Ring ◽  
Axis Direction ◽  
Compound C ◽  
Ring Molecules ◽  
A Chain

In the title compound, C5HN7, the nitrile and azido substituents are close to being coplanar with the central ring. Molecules in the crystal are linkedviaan N—H...N hydrogen bond to a nitrile acceptor, forming a chain extending along thec-axis direction.

scholarly journals Crystal structure of tetraethyl 27,30-dioxo-7,12,20,25-tetra-tert-butyl-3,16-dioxa-9,22,28,31-tetrathiaheptacyclo[21.3.1.11,5.14,8.110,14.114,18.117,21]dotriaconta-4,6,8(29),10,12,17,19,21(32),23,25-decaene-2,2,15,15-tetracarboxylate

2015 ◽  
Vol 71 (10) ◽  
pp. o778-o779
Author(s):  
Mehmet Akkurt ◽  
Jerry P. Jasinski ◽  
Shaaban K. Mohamed ◽  
Omran A. Omran ◽  
Mustafa R. Albayati
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Title Compound ◽  
Membered Ring ◽  
Asymmetric Unit ◽  
Axis Direction ◽  
Tert Butyl ◽  
Envelope Conformation ◽  
Compound C ◽  
A Chain

The asymmetric unit of the title compound, C54H64O12S4, consists of one half of the molecule, which is located on an inversion centre. The heterocyclic six-membered ring adopts a distorted envelope conformation with the spiro C atom as the flap. In the crystal, molecules are linked by weak C—H...O hydrogen bonds with anR22(14) motif, forming a chain along theb-axis direction.

scholarly journals Crystal structure of 9-methacryloylanthracene

2015 ◽  
Vol 71 (4) ◽  
pp. 357-359 ◽  
Author(s):  
Aditya Agrahari ◽  
Patrick O. Wagers ◽  
Steven M. Schildcrout ◽  
John Masnovi ◽  
Wiley J. Youngs
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bond ◽  
Dihedral Angle ◽  
Title Compound ◽  
Ring System ◽  
Side Chain ◽  
Weak Hydrogen Bond ◽  
Axis Direction ◽  
Compound C ◽  
Centroid Distance

In the title compound, C18H14O, with systematic name 1-(anthracen-9-yl)-2-methylprop-2-en-1-one, the ketonic C atom lies 0.2030 (16) Å out of the anthryl-ring-system plane. The dihedral angle between the planes of the anthryl and methacryloyl moieties is 88.30 (3)° and the stereochemistry about the Csp2—Csp2bond in the side chain istransoid. In the crystal, the end rings of the anthryl units in adjacent molecules associate in parallel–planar orientations [shortest centroid–centroid distance = 3.6320 (7) Å]. A weak hydrogen bond is observed between an aromatic H atom and the O atom of a molecule displaced by translation in thea-axis direction, forming sheets of parallel-planar anthryl groups packing in this direction.

scholarly journals Crystal structure ofN1,N1-diethyl-N4-[(quinolin-2-yl)methylidene]benzene-1,4-diamine

2015 ◽  
Vol 71 (1) ◽  
pp. o49-o50 ◽  
Author(s):  
Md. Serajul Haque Faizi ◽  
Nazia Siddiqui ◽  
Saleem Javed
Keyword(s):  
Crystal Structure ◽  
Dihedral Angle ◽  
Title Compound ◽  
Axis Direction ◽  
Π Interactions ◽  
Compound C ◽  
A Chain

The title compound, C20H21N3, is non-planar with a dihedral angle between the planes of the quinoline and phenylenediamine rings of 9.40 (4)°. In the crystal, molecules are connected by C—H...π interactions, generating a chain extending along thea-axis direction. Weak C—H...π interactions also occur.

scholarly journals (2-Hydroxyphenyl)(4,2′:4′,4′′-terpyridin-6′-yl)methanone

IUCrData ◽  
2020 ◽  
Vol 5 (7) ◽  
Author(s):  
S. Devika ◽  
Noor Shahina Begum ◽  
Kiran B. Manjappa ◽  
Ding-Yah Yang
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bond ◽  
Title Compound ◽  
Phenyl Ring ◽  
Dihedral Angles ◽  
Central Ring ◽  
Pyridine Ligands ◽  
Compound C ◽  
Hydrogen Bonding Interactions ◽  
The Mean

The title compound, C22H15N3O2, can be described as a ketone with a phenol substituent and a terpyridine ligand coordinated to the carbonyl group. The three six-membered rings of the terpyridine ligand are not coplanar. The dihedral angles between the mean planes of the central ring and the external pyridine ligands are 22.77 (9) and 26.77 (7)°. The central ring of the terpyridine ligand is also not coplanar with the o-hydroxy phenyl ring, the dihedral angle being 39.72 (5)°. An intramolecular O—H...O hydrogen bond occurs. The crystal structure of the title compound is consolidated by C—H...O and C—H...N hydrogen bonding interactions.

scholarly journals 3-(1H-Indol-3-yl)-2-benzofuran-1(3H)-one

IUCrData ◽  
2017 ◽  
Vol 2 (1) ◽  
Author(s):  
R. Anil Kumar ◽  
S. Naveen ◽  
M. Abdul Rahiman ◽  
K. M. Mahadevan ◽  
M. N. Kumara ◽  
...  
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bond ◽  
Dihedral Angle ◽  
Title Compound ◽  
Indole Ring ◽  
Ring Systems ◽  
Axis Direction ◽  
Compound C

In the title compound, C16H11NO2, the benzofuran and indole ring systems are nearly orthogonal, subtending a dihedral angle of 86.55 (4)°. The crystal structure features an N—H...O hydrogen bond, which leads to the formation of chains propagating along thea-axis direction.

scholarly journals Crystal structure of 2-benzamido-N-(2,2-diethoxyethyl)benzamide

2015 ◽  
Vol 71 (3) ◽  
pp. o214-o215
Author(s):  
Abdelaaziz Ouahrouch ◽  
Moha Taourirte ◽  
Hassan B. Lazrek ◽  
Joachim W. Engels ◽  
Michael Bolte
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bond ◽  
Dihedral Angle ◽  
Title Compound ◽  
Molecular Conformation ◽  
Crystal Packing ◽  
Aromatic Rings ◽  
Peptide Bonds ◽  
Axis Direction ◽  
Compound C

In the title compound, C20H24N2O4, both peptide bonds adopt atransconfiguration with respect to the —N—H and —C=O groups. The dihedral angle between the aromatic rings is 53.58 (4)°. The molecular conformation is stabilized by an intramolecular N—H...O hydrogen bond. The crystal packing is characterized by zigzag chains of N—H...O hydrogen-bonded molecules running along theb-axis direction.

scholarly journals Crystal structure of (S)-2-amino-2-methylsuccinic acid

2015 ◽  
Vol 71 (10) ◽  
pp. o731-o732 ◽  
Author(s):  
Isao Fujii
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bond ◽  
Hydrogen Bonds ◽  
Succinic Acid ◽  
Title Compound ◽  
Three Dimensional ◽  
Axis Direction ◽  
Compound C ◽  
Methylsuccinic Acid ◽  
Ring Motif

The title compound, C5H9NO4, crystallized as a zwitterion. There is an intramolecular N—H...O hydrogen bond involving thetrans-succinic acid and the ammonium group, forming anS(6) ring motif. In the crystal, molecules are linked by O—H...O hydrogen bonds, formingC(7) chains along thec-axis direction. The chains are linked by N—H...O and C—H...O hydrogen bonds, forming sheets parallel to thebcplane. Further N—H...O hydrogen bonds link the sheets to form a three-dimensional framework.

scholarly journals Crystal structure of 2-[4-(methylsulfanyl)quinazolin-2-yl]-1-phenylethanol

2014 ◽  
Vol 70 (10) ◽  
pp. o1101-o1101 ◽  
Author(s):  
Gamal A. El-Hiti ◽  
Keith Smith ◽  
Amany S. Hegazy ◽  
Mansour D. Ajarim ◽  
Benson M. Kariuki
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bond ◽  
Title Compound ◽  
Phenyl Group ◽  
Ring System ◽  
Interplanar Angle ◽  
Axis Direction ◽  
Compound C ◽  
Hydroxy Groups

In the molecule of the title compound, C17H16N2OS, the almost planar methylsulfanylquinazoline group [the methyl C atom deviates by 0.032 (2) Å from the plane through the ring system] forms an interplanar angle of 76.26 (4)° with the plane of the phenyl group. An intramolecular O—H...N hydrogen bond is present between the quinazoline and hydroxy groups. In the crystal, molecules are stacked along theb-axis direction.

scholarly journals Crystal structure of (E)-N′-(3-fluoro-2-hydroxybenzylidene)isonicotinohydrazide

2017 ◽  
Vol 73 (8) ◽  
pp. 1151-1153
Author(s):  
Suwadee Jiajaroen ◽  
Kittipong Chainok ◽  
Filip Kielar
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bond ◽  
Hydrogen Bonds ◽  
Dihedral Angle ◽  
Title Compound ◽  
Axis Direction ◽  
Π Interactions ◽  
Compound C ◽  
Centroid Distance ◽  
Ring Motif

In the title compound, C13H10FN3O2, the molecule has an E conformation with respect to the C=N bond of the hydrazone bridge. The dihedral angle between the isonicotinoyl and fluorophenol moieties is 4.03 (4)°, and an intramolecular O—H...N hydrogen bond generates an S(6) ring motif. In the crystal, molecules are linked by N—H...N and C—H...N hydrogen bonds, forming chains propagating along the a-axis direction. The chains are linked by C—H...O hydrogen bonds, resulting in the formation of layers lying parallel to the ab plane. The crystal structure also features π–π interactions [centroid-to-centroid distance = 3.6887 (8) Å].

N-(2-Pyridylcarbonyl)benzamide

2007 ◽  
Vol 63 (3) ◽  
pp. o1455-o1456 ◽  
Author(s):  
Gilles Gasser ◽  
Helen Stoeckli-Evans
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bond ◽  
Hydrogen Bonds ◽  
Polymer Chain ◽  
Title Compound ◽  
Phenyl Ring ◽  
Pyridine Ring ◽  
Axis Direction ◽  
Compound C ◽  
Phenyl Rings

The title compound, C13H10N2O2, has a Z,Z (trans–trans) arrangement of the central CONHCO group and an intramolecular N—H...N hydrogen bond. The molecule has a twisted conformation; the pyridine ring, which is almost parallel to the plane of the amide function at position 2, is inclined to the phenyl ring by 50.05 (6)°. In the crystal structure, symmetry-related molecules are linked by C—H...O hydrogen bonds, forming a zigzag polymer chain extending in the a-axis direction. The chains are linked by a C—H...π interaction involving phenyl rings of adjacent chains. There is also a π–π interaction involving pyridine rings related by a center of symmetry.

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