1986
DOI: 10.1107/s0108270186093757
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Crystal phases obtained from aqueous solutions of sodium dodecyl sulfate. The structure of a monoclinic phase of sodium dodecyl sulfate hemihydrate

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Cited by 33 publications
(43 citation statements)
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“…The E map C(112) 1.580(2) computed with the phases of the second set having the Rb(2) 0.5080 (1) S(2) 0.6055 (2) highest figures of merit revealed molecular fragments: o (21) 0.4612 (6) the location of all the non-H atoms was completed by o(22) 0.7451 (8) 0 (23) 0.6748 (7) Fourier recycling, o(24) 0.4917 (8) After isotropic and anisotropic refinement of the c (21) 0.394 (1) C (22) 0.230 (1) heavy atoms by block-diagonal least-squares method, C(23) 0-158 (1) all the H atoms were found from successive AF c(24) -0.022 (1) C (25) -0.091 (1) syntheses: their positional parameters were varied in the C (26) -0-273 (1) C (27) -0.341 (1) last cycles of refinement keeping fixed their isotropic c (28) (7) -0.1153 (2) 3.8 (1) 0.4101 (8) -0.0959 (2) 4.7 (2) 0.1461 (7) -0-0582 (2) 3.6 (1) 0.3986 (7) -0.0465 (2) 3-9 (1) 0.320 (1 structural features may be ascribed to the negative charge equally shared among the three non-ester O atoms, as already observed for the monoclinic and triclinic phases of sodium dodecyl sulfate (SDS) (Coiro, Mazza & Pochetti, 1986;Coiro, Manigrasso, Mazza & Pochetti, 1987). The conformation of both independent hydrocarbon chains is almost completely trans-planar: the largest deviations from planarity in the two chains are shown from the sequences C(12)-C(13)-C(14)-C(15) and C(21)-C(22)-C(23)-C(24) with torsion angles of 175-7 (7) and 174.6 (7) °, respectively.…”
supporting
confidence: 56%
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“…The E map C(112) 1.580(2) computed with the phases of the second set having the Rb(2) 0.5080 (1) S(2) 0.6055 (2) highest figures of merit revealed molecular fragments: o (21) 0.4612 (6) the location of all the non-H atoms was completed by o(22) 0.7451 (8) 0 (23) 0.6748 (7) Fourier recycling, o(24) 0.4917 (8) After isotropic and anisotropic refinement of the c (21) 0.394 (1) C (22) 0.230 (1) heavy atoms by block-diagonal least-squares method, C(23) 0-158 (1) all the H atoms were found from successive AF c(24) -0.022 (1) C (25) -0.091 (1) syntheses: their positional parameters were varied in the C (26) -0-273 (1) C (27) -0.341 (1) last cycles of refinement keeping fixed their isotropic c (28) (7) -0.1153 (2) 3.8 (1) 0.4101 (8) -0.0959 (2) 4.7 (2) 0.1461 (7) -0-0582 (2) 3.6 (1) 0.3986 (7) -0.0465 (2) 3-9 (1) 0.320 (1 structural features may be ascribed to the negative charge equally shared among the three non-ester O atoms, as already observed for the monoclinic and triclinic phases of sodium dodecyl sulfate (SDS) (Coiro, Mazza & Pochetti, 1986;Coiro, Manigrasso, Mazza & Pochetti, 1987). The conformation of both independent hydrocarbon chains is almost completely trans-planar: the largest deviations from planarity in the two chains are shown from the sequences C(12)-C(13)-C(14)-C(15) and C(21)-C(22)-C(23)-C(24) with torsion angles of 175-7 (7) and 174.6 (7) °, respectively.…”
supporting
confidence: 56%
“…With the aim of obtaining models to be successively tested in the study of micellar solutions with different techniques we have undertaken the elucidation of crystalline phases of dodecyl sulfates which can be grown from aqueous solutions at a concentration above the critical micellar concentration (Coiro, Mazza & Pochetti, 1986;Coiro, Manigrasso, Mazza & Pochetti, 1987;Coiro, Mazza & Pochetti, 1987). Furthermore, since the micellar growth is very sensitive to the nature of the counterion (Missel, Mazer, Carey & Benedek, 1982), in order to investigate the effect of the counterion on the molecular aggregation of surfactants we are also examining the crystal packing of the same anionic amphiphile with different cations.…”
mentioning
confidence: 99%
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“…The crystal structures of sodium dodecyl sulfate hydrate with varying water content have been reported by several authors (Sundell, 1977;Coiro, Mazza & Pochetti, 1986;Coiro, Manigrasso, Mazza & Pochetti, 1987). The role of head groups in the structural arrangement can be demonstrated by a comparison of the crystal structures of sodium dodecyl sulfate and sodium dodecylene disulfate.…”
Section: Commentmentioning
confidence: 99%
“…In order to obtain models of micellar aggregates formed from sodium dodecyl sulfate (SDS) and to verify them with various techniques in the study of micellar solutions, we are following a strategy successfully applied in the structural elucidation of deoxycholate micelles (Campanelli, Candeloro De Sanctis, Giglio & Petriconi, 1984;Conte, Di Blasi, Giglio, Parretta & Pavel, 1984;Esposito, Zanobi, Giglio, Pavel & Campbell, 1987;Esposito, Giglio, Pavel & Zanobi, 1987;Giglio, Loreti & Pavel, 1988). Therefore, crystal phases of sodium dodecyl sulfate, obtained from aqueous solutions at a concentration above the critical micellar concentration, have been investigated by X-ray crystallography (Coiro, Mazza & Pochetti, 1986Coiro, Manigrasso, Mazza & Pochetti, 1987). Furthermore, since micellization is very sensitive to the properties of the counterion (e.g.…”
Section: 19gcm-3 T(cuka)=l5418a #(Cuka)=mentioning
confidence: 99%