Hydrogen bonding in thiourea: Diethyl oxalate complex in 2:1 ratio

Chitra, R. and Amit Das and Choudhury, R. R. and Ramanadham, M. and Lakshmi, S. and Sridhar, M. A. and Shashidhara Prasad, J. (2005) Hydrogen bonding in thiourea: Diethyl oxalate complex in 2:1 ratio. Journal of Chemical Crystallography, 35 (7). pp. 509-512. ISSN 1572-8854

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Official URL: https://doi.org/10.1007/s10870-005-2853-9


The crystal structure of thiourea:diethyl oxalate in 2:1 ratio is the first of its kind where the diethyl oxalate exists as a solid which otherwise is a liquid at room temperature. It crystallizes in triclinic centrosymmetric space group P-1 with the following unit cell dimensions a = 7.1870(7) Å, b = 7.4890(8) Å, c = 8.3637(7) Å, α = 63.783(7)∘, β = 67.41(1)∘, γ = 64.933(7)∘. The R-factor = 0.0386 for 1850 Fo > 4σ (Fo) and 0.0417 for all 2020 data. There is a center of inversion at the center of the C–C bond of diethyl oxalate. This system is stabilized by N–H ⋅s S and N–H ⋅s O hydrogen bonds.

Item Type: Article
Subjects: D Physical Science > Physics
Divisions: Department of > Physics
Depositing User: Manjula P Library Assistant
Date Deposited: 05 Sep 2019 09:47
Last Modified: 25 Oct 2019 09:48
URI: http://eprints.uni-mysore.ac.in/id/eprint/7642

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