(4-Nitrophenylsulfinyl)acetic acid, a three dimensional hydrogen-bonded framework built from a combination of two-centre O–H  and C–H  hydrogen bonds and a three-centre C–H 2 hydrogen bond

C  Glidewell; J N  Low; J M S  Skakle; J L  Wardell

doi:10.1107/S0108270103001860

(4-Nitrophenylsulfinyl)acetic acid, a three dimensional hydrogen-bonded framework built from a combination of two-centre O–H and C–H hydrogen bonds and a three-centre C–H 2 hydrogen bond

C Glidewell
, J N Low
, J M S Skakle
, J L Wardell

Physics

Research output: Contribution to journal › Article › peer-review

5 Citations (Scopus)

Abstract

Molecules of the title compound, C8H7NO5S, are linked into sheets by a combination of two-centre hydrogen bonds, one of type O-H...O [H...O = 1.81 Angstrom, O...O = 2.648 (2) Angstrom and O-H...O = 173degrees] and three of type C-H...O [H...O = 2.40-2.48 Angstrom, C...O = 3.206 (3)-3.391 (3) Angstrom and C-H ... O = 131-160degrees]. These sheets are linked by an unusual three-centre C-H...(O)(2) hydrogen bond [H...O = 2.46 and 2.56 Angstrom, C...O = 3.289 (3) and 3.351 (3) Angstrom, and C-H...O = 141 and 137degrees], in which the two acceptors are carboxyl and sulfoxide O atoms.

Original language	English
Pages (from-to)	o124-o126
Number of pages	3
Journal	Acta Crystallographica Section C, Crystal Structure Communications
Volume	C59
DOIs	https://doi.org/10.1107/S0108270103001860
Publication status	Published - 2003

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Glidewell, C., Low, J. N., Skakle, J. M. S., & Wardell, J. L. (2003). (4-Nitrophenylsulfinyl)acetic acid, a three dimensional hydrogen-bonded framework built from a combination of two-centre O–H and C–H hydrogen bonds and a three-centre C–H 2 hydrogen bond. Acta Crystallographica Section C, Crystal Structure Communications, C59, o124-o126. https://doi.org/10.1107/S0108270103001860

(4-Nitrophenylsulfinyl)acetic acid, a three dimensional hydrogen-bonded framework built from a combination of two-centre O–H and C–H hydrogen bonds and a three-centre C–H 2 hydrogen bond. / Glidewell, C ; Low, J N ; Skakle, J M S et al.
In: Acta Crystallographica Section C, Crystal Structure Communications, Vol. C59, 2003, p. o124-o126.

Research output: Contribution to journal › Article › peer-review

Glidewell, C, Low, JN, Skakle, JMS & Wardell, JL 2003, '(4-Nitrophenylsulfinyl)acetic acid, a three dimensional hydrogen-bonded framework built from a combination of two-centre O–H and C–H hydrogen bonds and a three-centre C–H 2 hydrogen bond', Acta Crystallographica Section C, Crystal Structure Communications, vol. C59, pp. o124-o126. https://doi.org/10.1107/S0108270103001860

@article{058186b46ee64a8aaf006424aecf64a4,

title = "(4-Nitrophenylsulfinyl)acetic acid, a three dimensional hydrogen-bonded framework built from a combination of two-centre O–H and C–H hydrogen bonds and a three-centre C–H 2 hydrogen bond",

abstract = "Molecules of the title compound, C8H7NO5S, are linked into sheets by a combination of two-centre hydrogen bonds, one of type O-H...O [H...O = 1.81 Angstrom, O...O = 2.648 (2) Angstrom and O-H...O = 173degrees] and three of type C-H...O [H...O = 2.40-2.48 Angstrom, C...O = 3.206 (3)-3.391 (3) Angstrom and C-H ... O = 131-160degrees]. These sheets are linked by an unusual three-centre C-H...(O)(2) hydrogen bond [H...O = 2.46 and 2.56 Angstrom, C...O = 3.289 (3) and 3.351 (3) Angstrom, and C-H...O = 141 and 137degrees], in which the two acceptors are carboxyl and sulfoxide O atoms.",

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doi = "10.1107/S0108270103001860",

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T1 - (4-Nitrophenylsulfinyl)acetic acid, a three dimensional hydrogen-bonded framework built from a combination of two-centre O–H and C–H hydrogen bonds and a three-centre C–H 2 hydrogen bond

AU - Glidewell, C

AU - Low, J N

AU - Skakle, J M S

AU - Wardell, J L

PY - 2003

Y1 - 2003

N2 - Molecules of the title compound, C8H7NO5S, are linked into sheets by a combination of two-centre hydrogen bonds, one of type O-H...O [H...O = 1.81 Angstrom, O...O = 2.648 (2) Angstrom and O-H...O = 173degrees] and three of type C-H...O [H...O = 2.40-2.48 Angstrom, C...O = 3.206 (3)-3.391 (3) Angstrom and C-H ... O = 131-160degrees]. These sheets are linked by an unusual three-centre C-H...(O)(2) hydrogen bond [H...O = 2.46 and 2.56 Angstrom, C...O = 3.289 (3) and 3.351 (3) Angstrom, and C-H...O = 141 and 137degrees], in which the two acceptors are carboxyl and sulfoxide O atoms.

AB - Molecules of the title compound, C8H7NO5S, are linked into sheets by a combination of two-centre hydrogen bonds, one of type O-H...O [H...O = 1.81 Angstrom, O...O = 2.648 (2) Angstrom and O-H...O = 173degrees] and three of type C-H...O [H...O = 2.40-2.48 Angstrom, C...O = 3.206 (3)-3.391 (3) Angstrom and C-H ... O = 131-160degrees]. These sheets are linked by an unusual three-centre C-H...(O)(2) hydrogen bond [H...O = 2.46 and 2.56 Angstrom, C...O = 3.289 (3) and 3.351 (3) Angstrom, and C-H...O = 141 and 137degrees], in which the two acceptors are carboxyl and sulfoxide O atoms.

U2 - 10.1107/S0108270103001860

DO - 10.1107/S0108270103001860

M3 - Article

SN - 0108-2701

VL - C59

SP - o124-o126

JO - Acta Crystallographica Section C, Crystal Structure Communications

JF - Acta Crystallographica Section C, Crystal Structure Communications

ER -

(4-Nitrophenylsulfinyl)acetic acid, a three dimensional hydrogen-bonded framework built from a combination of two-centre O–H and C–H hydrogen bonds and a three-centre C–H 2 hydrogen bond

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