(E)-2-Bromo-4,5-dimethoxybenzaldehyde oxime

2006 ◽  
Vol 62 (5) ◽  
pp. o1946-o1947
Author(s):  
Xiang Li ◽  
Da-Min Tian
Keyword(s):  
Hydrogen Bonds ◽  
Title Compound ◽  
Crystal Packing ◽  
Stacking Interactions ◽  
Asymmetric Unit ◽  
Bond Lengths ◽  
Compound C ◽  
Π Stacking ◽  
Independent Molecules

The title compound, C9H10BrNO3, which exists as the E isomer, crystallizes with two independent molecules in the asymmetric unit. The bond lengths and angles in both molecules are normal. The crystal packing is stabilized by intermolecular O—H...O hydrogen bonds, which link the molecules into circular tetramers, and by weak π–π stacking interactions.

scholarly journals (Z)-1-(2-Chlorophenyl)-3-methyl-4-[2-(4-nitrophenyl)hydrazin-1-ylidene]-1H-pyrazol-5(4H)-one

2012 ◽  
Vol 68 (8) ◽  
pp. o2351-o2352 ◽  
Author(s):  
Carlos Bustos ◽  
Andrés Escobar-Fuentealba ◽  
Luis Alvarez-Thon ◽  
Rodrigo Faundez-Gutierrez ◽  
Maria Teresa Garland
Keyword(s):  
Hydrogen Bonds ◽  
Title Compound ◽  
Crystal Packing ◽  
Pyrazole Ring ◽  
Dihedral Angles ◽  
Stacking Interactions ◽  
Asymmetric Unit ◽  
Compound C ◽  
Π Stacking ◽  
Independent Molecules

There are two independent molecules,AandB, in the asymmetric unit of the title compound, C16H12ClN5O3. The relative orientations of the chlorophenyl ring with respect to the pyrazole ring in the two crystallographically independent molecules are different, and their corresponding dihedral angles are −53.3 (2) and 114.09 (18)° in moleculesAandB, respectively. There are two strong intramolecular N—H...O hydrogen bonds, and two weak intramolecular C—H...O and C—H...Cl hydrogen bonds. The crystal packing is constructed by weak C—H...O and N—H...O interactions, and two π–π stacking interactions [centroid–centroid distances = 3.7894 (9) and 3.5719 (10) Å], forming a molecular ladder along theaaxis.

scholarly journals 4-(Prop-2-yn-1-ylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidine

IUCrData ◽  
2017 ◽  
Vol 2 (10) ◽  
Author(s):  
Mohamed El Hafi ◽  
Mohammed Boulhaoua ◽  
Youssef Ramli ◽  
Mohammed Benchidmi ◽  
El Mokhtar Essassi ◽  
...  
Keyword(s):  
Hydrogen Bonds ◽  
Title Compound ◽  
Side Chain ◽  
Stacking Interactions ◽  
Asymmetric Unit ◽  
Axis Direction ◽  
Compound C ◽  
Π Stacking ◽  
Two Component ◽  
Independent Molecules

The asymmetric unit of the title compound, C8H6N4S, consists of two independent molecules differing in the orientation of the side chain. In the crystal, molecules form dimers through N—H...N hydrogen bonds. The dimers stack along thea-axis direction with weak π–π stacking interactions [centroid–centroid distances of 3.898 (2) and 3.908 (2) Å]. The crystal studied was refined as a two-component twin.

scholarly journals 1-Benzyl-3-methylquinoxalin-2(1H)-one

IUCrData ◽  
2018 ◽  
Vol 3 (3) ◽  
Author(s):  
Youssef Ramli ◽  
Youness El Bakri ◽  
L'houssaine El Ghayati ◽  
El Mokhtar Essassi ◽  
Joel T. Mague
Keyword(s):  
Hydrogen Bonds ◽  
Title Compound ◽  
Stacking Interactions ◽  
Independent Molecule ◽  
Asymmetric Unit ◽  
Axis Direction ◽  
The Third ◽  
Compound C ◽  
Π Stacking ◽  
Independent Molecules

The asymmetric unit of the title compound, C16H14N2O, contains three independent molecules differing primarily in the orientations of the benzyl groups. Each independent molecule forms inversion related dimersviaoffset π-stacking interactions. For two of these dimers, stacks are formed approximately along thea-axis direction by a combinations of C—H...N and C—H...π(ring) contacts, in addition to the offset π-stacking interactions. The third set of dimers are also stacked in the same direction but only by pairwise C—H...N hydrogen bonds.

4-Amino-6-chloro-8-p-tolylpteridin-7(8H)-one dichloromethane hemisolvate

2006 ◽  
Vol 62 (7) ◽  
pp. o2680-o2682
Author(s):  
Chong-Gang Duan ◽  
Jiong Jia ◽  
Jian-Wu Wang
Keyword(s):  
Hydrogen Bonds ◽  
Title Compound ◽  
Crystal Packing ◽  
Van Der Waals ◽  
Van Der Waals Forces ◽  
Asymmetric Unit ◽  
Bond Lengths ◽  
Compound C ◽  
Normal Ranges ◽  
Independent Molecules

The title compound, C13H10ClN5O·0.5CH2Cl2, crystallizes with two independent 4-amino-6-chloro-8-p-tolylpteridin-7(8H)-one molecules and one dichloromethane molecule in the asymmetric unit. The bond lengths and angles in the molecules are within normal ranges. Intermolecular N—H...N hydrogen bonds link the two independent molecules into hydrogen-bonded dimers. The crystal packing is further stabilized by van der Waals forces.

scholarly journals A new polymorph of 5,5′-(ethane-1,2-diyl)bis(1H-tetrazole)

2012 ◽  
Vol 68 (4) ◽  
pp. o989-o989 ◽  
Author(s):  
Cheng-Fang Qiao ◽  
Chun-Sheng Zhou ◽  
Qing Wei ◽  
Zheng-Qiang Xia
Keyword(s):  
Hydrogen Bonds ◽  
Title Compound ◽  
Crystal Packing ◽  
Mirror Plane ◽  
Stacking Interactions ◽  
Asymmetric Unit ◽  
Compound C ◽  
Π Stacking ◽  
Centroid Distance

The asymmetric unit of the title compound, C4H6N8, contains a quarter of the molecule, which possesses a crystallographically imposed centre of symmetry with all non-H atoms situated on a mirror plane. The crystal packing exhibits intermolecular N—H...N hydrogen bonds and π–π stacking interactions between the tetrazole rings of adjacent molecules [centroid–centroid distance = 3.4402 (10) Å].

scholarly journals 3-Bromo-6-nitro-1-(prop-2-en-1-yl)-1H-indazole

IUCrData ◽  
2018 ◽  
Vol 3 (1) ◽  
Author(s):  
Mohamed Mokhtar Mohamed Abdelahi ◽  
Youness El Bakri ◽  
Mohammed Benchidmi ◽  
El Mokhtar Essassi ◽  
Joel T. Mague
Keyword(s):  
Hydrogen Bonds ◽  
Title Compound ◽  
Crystal Packing ◽  
Asymmetric Unit ◽  
Torsion Angles ◽  
Compound C ◽  
Π Stacking ◽  
Two Component ◽  
Independent Molecules

The asymmetric unit of the title compound, C10H8BrN3O2, contains two independent molecules differing primarily in the orientations of the allyl substituents [N—C—C=C torsion angles = −125.4 (16) and 116.0 (16)°]. The crystal packing involves slipped π–π stacking of indazole units, together with weak C—H...O and C—H...Br hydrogen bonds. The crystal studied was refined as a two-component twin.

2,3-Dihydro-1,5-benzothiazepin-4(5H)-one

2006 ◽  
Vol 62 (5) ◽  
pp. o1831-o1832 ◽  
Author(s):  
Bing-Yi Qin ◽  
Gui-Long Zhao
Keyword(s):  
Hydrogen Bonds ◽  
Title Compound ◽  
Crystal Packing ◽  
Van Der Waals ◽  
Van Der Waals Forces ◽  
Asymmetric Unit ◽  
Bond Lengths ◽  
Compound C ◽  
Normal Ranges ◽  
Independent Molecules

The title compound, C9H9NOS, crystallizes with two independent molecules in the asymmetric unit. The bond lengths and angles in both molecules are within normal ranges. The crystal packing is stabilized by intermolecular N—H...O hydrogen bonds and van der Waals forces.

scholarly journals 5-Fluoro-1-(prop-2-en-1-yl)-2,3-dihydro-1H-indole-2,3-dione

IUCrData ◽  
2017 ◽  
Vol 2 (1) ◽  
Author(s):  
Fatim-Zahrae Qachchachi ◽  
Joel T. Mague ◽  
Youssef Kandri Rodi ◽  
Amal Haoudi ◽  
Younes Ouzidan ◽  
...  
Keyword(s):  
Hydrogen Bonds ◽  
Title Compound ◽  
Stacking Interactions ◽  
Asymmetric Unit ◽  
Axis Direction ◽  
Compound C ◽  
Π Stacking ◽  
Independent Molecules

The asymmetric unit of the title compound, C11H8FNO2, consists of two independent molecules having different conformations and associated through pairwise C—H...F hydrogen bonds. These units form `stairstep' stacks along theb-axis directionviaπ–π stacking interactions between dihydroindole moieties, with interplanar spacings of 3.578 (3) and 3.627 (3) Å. The stacks are tied together by weak C—H...O hydrogen bonds.

3-n-Butyl-2-methoxy-1-benzothieno[3,2-d]pyrimidin-4(3H)-one

2006 ◽  
Vol 62 (4) ◽  
pp. o1319-o1320 ◽  
Author(s):  
Min-Hui Cao ◽  
Sheng-Zhen Xu ◽  
Yang-Gen Hu
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonding ◽  
Benzene Ring ◽  
Title Compound ◽  
Thiophene Ring ◽  
Stacking Interactions ◽  
Asymmetric Unit ◽  
Compound C ◽  
Π Stacking ◽  
Independent Molecules

The title compound, C15H16N2O2S, contains a five-membered thiophene ring fused to a benzene ring and a substituted pyrimidinone ring. All three rings in each of the independent molecules of the asymmetric unit lie in approximately the same plane. The crystal structure is stabilized by intermolecular C—H...O hydrogen bonding and π–π stacking interactions.

5-Nitrosalicylaldehyde (2-hydroxybenzoyl)hydrazone

2006 ◽  
Vol 62 (7) ◽  
pp. o3026-o3027 ◽  
Author(s):  
Hong-Mei Xu ◽  
Shi-Xiong Liu
Keyword(s):  
Hydrogen Bonds ◽  
Title Compound ◽  
Crystal Packing ◽  
Dihedral Angles ◽  
Stacking Interactions ◽  
Aromatic Rings ◽  
Compound C ◽  
Π Stacking

The molecule of the title compound, C14H11N3O5, is approximately planar, the dihedral angles between the two aromatic rings being 4.63 (7)°. O—H...N, N—H...O and O—H...O hydrogen bonds and π–π stacking interactions help to consolidate the crystal packing.

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