The supramolecular structure of N-(6-amino-3,4-di-hydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl)glycyl-glycinate contains a unique O-H center dot center dot center dot N(nitroso) hydrogen bond

J N  Low; A  Quesada; C  Glidewell; M A  Fontecha; P  Arranz; M L  Godino; R  Lopez

doi:10.1107/S1600536802013405

The supramolecular structure of N-(6-amino-3,4-di-hydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl)glycyl-glycinate contains a unique O-H center dot center dot center dot N(nitroso) hydrogen bond

J N Low, A Quesada, C Glidewell, M A Fontecha, P Arranz, M L Godino, R Lopez

School of Chemistry

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

Abstract

The molecular structure of the title compound, C9H12N6O5, shows extensive electronic delocalization involving the pyrimidine ring and the attached N atom of the glycylglycinate, the amino and the nitroso groups. A unique O-H...N(nitroso) hydrogen bond of 2.748 (2) Angstrom is found in the structure. The supramolecular structure is a three-dimensional network, derived from two sets of antiparallel chains, which link chains of alternating dimers which are formed by the action of two different crystallographic centres of symmetry.

Original language	English
Number of pages	4
Journal	Acta Crystallographica. Section E, Structure reports online
Volume	58
DOIs	https://doi.org/10.1107/S1600536802013405
Publication status	Published - Aug 2002

Keywords

COORDINATION POLYMER

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Low, J. N., Quesada, A., Glidewell, C., Fontecha, M. A., Arranz, P., Godino, M. L., & Lopez, R. (2002). The supramolecular structure of N-(6-amino-3,4-di-hydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl)glycyl-glycinate contains a unique O-H center dot center dot center dot N(nitroso) hydrogen bond. Acta Crystallographica. Section E, Structure reports online, 58. https://doi.org/10.1107/S1600536802013405

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title = "The supramolecular structure of N-(6-amino-3,4-di-hydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl)glycyl-glycinate contains a unique O-H center dot center dot center dot N(nitroso) hydrogen bond",

abstract = "The molecular structure of the title compound, C9H12N6O5, shows extensive electronic delocalization involving the pyrimidine ring and the attached N atom of the glycylglycinate, the amino and the nitroso groups. A unique O-H...N(nitroso) hydrogen bond of 2.748 (2) Angstrom is found in the structure. The supramolecular structure is a three-dimensional network, derived from two sets of antiparallel chains, which link chains of alternating dimers which are formed by the action of two different crystallographic centres of symmetry.",

keywords = "COORDINATION POLYMER",

author = "Low, \{J N\} and A Quesada and C Glidewell and Fontecha, \{M A\} and P Arranz and Godino, \{M L\} and R Lopez",

year = "2002",

month = aug,

doi = "10.1107/S1600536802013405",

language = "English",

volume = "58",

journal = "Acta Crystallographica. Section E, Structure reports online",

issn = "1600-5368",

publisher = "International Union of Crystallography",

}

Low, JN, Quesada, A, Glidewell, C, Fontecha, MA, Arranz, P, Godino, ML & Lopez, R 2002, 'The supramolecular structure of N-(6-amino-3,4-di-hydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl)glycyl-glycinate contains a unique O-H center dot center dot center dot N(nitroso) hydrogen bond', Acta Crystallographica. Section E, Structure reports online, vol. 58. https://doi.org/10.1107/S1600536802013405

The supramolecular structure of N-(6-amino-3,4-di-hydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl)glycyl-glycinate contains a unique O-H center dot center dot center dot N(nitroso) hydrogen bond. / Low, J N ; Quesada, A ; Glidewell, C et al.
In: Acta Crystallographica. Section E, Structure reports online, Vol. 58, 08.2002.

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

TY - JOUR

T1 - The supramolecular structure of N-(6-amino-3,4-di-hydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl)glycyl-glycinate contains a unique O-H center dot center dot center dot N(nitroso) hydrogen bond

AU - Low, J N

AU - Quesada, A

AU - Glidewell, C

AU - Fontecha, M A

AU - Arranz, P

AU - Godino, M L

AU - Lopez, R

PY - 2002/8

Y1 - 2002/8

N2 - The molecular structure of the title compound, C9H12N6O5, shows extensive electronic delocalization involving the pyrimidine ring and the attached N atom of the glycylglycinate, the amino and the nitroso groups. A unique O-H...N(nitroso) hydrogen bond of 2.748 (2) Angstrom is found in the structure. The supramolecular structure is a three-dimensional network, derived from two sets of antiparallel chains, which link chains of alternating dimers which are formed by the action of two different crystallographic centres of symmetry.

AB - The molecular structure of the title compound, C9H12N6O5, shows extensive electronic delocalization involving the pyrimidine ring and the attached N atom of the glycylglycinate, the amino and the nitroso groups. A unique O-H...N(nitroso) hydrogen bond of 2.748 (2) Angstrom is found in the structure. The supramolecular structure is a three-dimensional network, derived from two sets of antiparallel chains, which link chains of alternating dimers which are formed by the action of two different crystallographic centres of symmetry.

KW - COORDINATION POLYMER

U2 - 10.1107/S1600536802013405

DO - 10.1107/S1600536802013405

M3 - Article

SN - 1600-5368

VL - 58

JO - Acta Crystallographica. Section E, Structure reports online

JF - Acta Crystallographica. Section E, Structure reports online

ER -

The supramolecular structure of N-(6-amino-3,4-di-hydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl)glycyl-glycinate contains a unique O-H center dot center dot center dot N(nitroso) hydrogen bond

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