Salam, Abdul Ajees Abdul (2017) Structural analysis of chalcone derivative: 2‐{4‐[(2E)‐3‐(4‐fluorophenyl)prop‐2‐enoyl]phenoxy}acetic acid hydrate. Chemical Data Collections, 9-10. pp. 61-67.
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Abstract
The crystal structure of the title compound has been determined from X-ray diffraction studies. The compound crystallizes from methanol in the monoclinic system with space group P21/c with unit cell parameters: a = 10.647 (8), b = 8.494 (6), c = 16.743 (12) Å, β = 92.731 (13)°, Z = 4, V = 1512.4(19) Å3. The structure was determined by direct methods and refined to a final R-factor of 0.06. The two six-membered rings, A and B are planar with RMS deviation of fitted atoms is 0.0041 Å and the structure is stabilized by strong Osingle bondH..O, weak Csingle bondH…O, and Csingle bondH…F interactions.
Item Type: | Article |
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Uncontrolled Keywords: | Chalcones; Single crystals; X-ray diffraction; NLO materials. |
Subjects: | Departments at MU > Atomic Molecular Physics |
Depositing User: | KMC Library |
Date Deposited: | 12 Jun 2017 04:11 |
Last Modified: | 12 Jun 2017 04:11 |
URI: | http://eprints.manipal.edu/id/eprint/149034 |
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