2007
DOI: 10.1107/s1600536807050155
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2-(2-Chlorophenyl)-7-methyl-4H-chromen-4-one

Abstract: Key indicators: single-crystal X-ray study; T = 298 K; mean (C-C) = 0.005 Å; R factor = 0.045; wR factor = 0.128; data-to-parameter ratio = 12.9.The title compound, C 16 H 11 ClO 2 , is a synthetic flavonoid. The fused-ring system is almost planar, with a mean deviation from the least-squares plane of 0.0204 (2) Å . The dihedral angle between the chromene group and the chlorophenyl ring is 50.9 (6) , due to unfavourable steric interactions with the Cl atom. Aromaticstacking interactions between the fused benze… Show more

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Cited by 5 publications
(8 citation statements)
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“…1) is composed of a planar chromone moiety (O1/C1-C9) with maximum deviation of 0.045 (2) Å for atom C8. Bond lengths and angles are similar to those observed in a structurally related compound (Wang & Kong, 2007). In the crystal (Fig.…”
Section: S1 Commentsupporting
confidence: 79%
See 1 more Smart Citation
“…1) is composed of a planar chromone moiety (O1/C1-C9) with maximum deviation of 0.045 (2) Å for atom C8. Bond lengths and angles are similar to those observed in a structurally related compound (Wang & Kong, 2007). In the crystal (Fig.…”
Section: S1 Commentsupporting
confidence: 79%
“…For the biological activity of chromone, see: Patel et al (2011); Khan et al (2009Khan et al ( , 2010; Gautam et al (2010); Ishar et al (2006); Hassan (1992); Nohara et al (1974). For a related structure, see: Wang & Kong (2007).…”
Section: Related Literaturementioning
confidence: 99%
“…For the biological activity of chromones, see: Patel et al (2011); Khan et al (2010); Gautam et al (2010). For a related structure, see: Wang & Kong (2007). Data collection: SMART (Bruker, 2000); cell refinement: SAINT (Bruker, 2000); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 2008); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008); molecular graphics: SHELXTL (Sheldrick, 2008); software used to prepare material for publication: SHELXTL and PARST (Nardelli, 1995) and PLATON (Spek, 2009).…”
Section: Related Literaturementioning
confidence: 99%
“…For related structures, see: Zhang et al (2008); Ghosh et al (2007); Wang & Kong (2007). For the synthesis, see: Burchell et al (2006).…”
Section: Related Literaturementioning
confidence: 99%
“…While π-π stacking interactions are often found in aromatics (Wang et al 2007), in the title complex the minimal distance between ring centroids is 5.188 (1) Å indicating that there are no π-π stacking interactions present (Steed et al 2000). (Fig.…”
Section: Sup-1mentioning
confidence: 99%