2-(5-Chloro-1,3-benzothia-zol-2-yl)-4-meth-oxy-phenol.

Acta Crystallogr Sect E Struct Rep Online

H.E.J. Research Institute of Chemistry, International Center for Chemical and Biological Sciences, University of Karachi, Karachi 75270, Pakistan.

Published: October 2012

In the mol-ecule of the title compound, C(14)H(10)ClNO(2)S, the dihedral angle between the almost planar benzothia-zole ring system [maximum deviation = 0.005 (2) Å] and the benzene ring is 1.23 (9)°. The conformation of the mol-ecule is stabilized by an intra-molecular O-H⋯N hydrogen bond, forming an S(6) ring motif. In the crystal, mol-ecules are linked into layers parallel to the ac plane by C-H⋯O hydrogen bonds and π-π stacking inter-actions [centroid-centroid distance = 3.7365 (12) Å].

Download full-text PDF

Source
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC3470231PMC
http://dx.doi.org/10.1107/S1600536812037804DOI Listing

Publication Analysis

Top Keywords

2-5-chloro-13-benzothia-zol-2-yl-4-meth-oxy-phenol mol-ecule
4
mol-ecule title
4
title compound
4
compound c14h10clno2s
4
c14h10clno2s dihedral
4
dihedral angle
4
angle planar
4
planar benzothia-zole
4
benzothia-zole ring
4
ring system
4

Similar Publications

The mol-ecular structure of the title compound, CHNO reveals non-co-planarity between the central formamidine backbone and each of the outer meth-oxy- and -propyl- substituted benzene rings with dihedral angles of 7.88 (15) and 81.17 (15)°, respectively, indicating significant twists in the mol-ecule.

View Article and Find Full Text PDF

The mol-ecule of the title compound, [Ni(CHO)(CHN)(HO)]·CHOH, has triclinic () symmetry. This compound is of inter-est for its anti-microbial properties. The asymmetric unit comprises two independent complex mol-ecules, which are linked by N-H⋯O and O-H⋯O hydrogen bonds along [111].

View Article and Find Full Text PDF

The crystal structure of the title compound, hexa-aqua-nickel(II) dichloride-1,4,7,10,13,16-hexa-oxa-cyclo-octa-deca-ne-water (1/2/2), [Ni(HO)]Cl·2CHO·2HO, is reported. The asymmetric unit contains half of the Ni(OH) moiety with a formula of CHClNiO at 105 K and triclinic (1) symmetry. The [Ni(OH)] cation has close to ideal octa-hedral geometry with O-Ni-O bond angles that are within 3° of idealized values.

View Article and Find Full Text PDF

The title compound, a hydrate of 3,5-di-amino-1,2,4-triazole (DATA), CHN·HO, was synthesized in the presence of sodium perchlorate. The evaporation of HO from its aqueous solution resulted in anhydrous DATA, suggesting that sodium perchlorate was required to precipitate the DATA hydrate. The DATA hydrate crystallizes in the 2/ space group in the form of needle-shaped crystals with one DATA and one water mol-ecule in the asymmetric unit.

View Article and Find Full Text PDF

In the title compound, CHN·2CHNO, 4-nitro-phenol and 4,4'-bi-pyridine crystallized together in a 2:1 ratio in the space group 2/. There is a hydrogen-bonding inter-action between the nitro-gen atoms on the 4,4'-bi-pyridine mol-ecule and the hydrogen atom on the hydroxyl group on the 4-nitro-phenol, resulting in trimolecular units. This structure is a polymorph of a previously reported structure [Nayak & Pedireddi (2016 ▸).

View Article and Find Full Text PDF

Want AI Summaries of new PubMed Abstracts delivered to your In-box?

Enter search terms and have AI summaries delivered each week - change queries or unsubscribe any time!