4,5,6-triamino-2-(methylsulfanyl)pyrimidine: pi-stacked hydrogen-bonded sheets of R-2(2)(8), R-2(2)(10) and R-6(6)(32) rings

J  Cobo; A S  Rodrigo; M N  Montiel; J N  Low; C  Glidewell

doi:10.1107/S0108270106003805

4,5,6-triamino-2-(methylsulfanyl)pyrimidine: pi-stacked hydrogen-bonded sheets of R-2(2)(8), R-2(2)(10) and R-6(6)(32) rings

J Cobo, A S Rodrigo, M N Montiel, J N Low, C Glidewell

School of Chemistry

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

Abstract

In the title compound, C5H9N5S, the three independent C-NH2 units are all somewhat pyramidal. The molecules are linked by a combination of one N-H center dot center dot center dot S and two N-H center dot center dot center dot N hydrogen bonds into sheets containing three types of ring motif, viz. R-2(2)(8), R-2(2)(10) and R-6(6)(32), all of them centrosymmetric. Adjacent sheets are linked by a single pi-pi stacking interaction.

Original language	English
Number of pages	3
Journal	Acta Crystallographica Section C-Crystal Structure Communications
Volume	62
DOIs	https://doi.org/10.1107/S0108270106003805
Publication status	Published - Mar 2006

Keywords

X-RAY
DIFFRACTION

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title = "4,5,6-triamino-2-(methylsulfanyl)pyrimidine: pi-stacked hydrogen-bonded sheets of R-2(2)(8), R-2(2)(10) and R-6(6)(32) rings",

abstract = "In the title compound, C5H9N5S, the three independent C-NH2 units are all somewhat pyramidal. The molecules are linked by a combination of one N-H center dot center dot center dot S and two N-H center dot center dot center dot N hydrogen bonds into sheets containing three types of ring motif, viz. R-2(2)(8), R-2(2)(10) and R-6(6)(32), all of them centrosymmetric. Adjacent sheets are linked by a single pi-pi stacking interaction.",

keywords = "X-RAY, DIFFRACTION",

author = "J Cobo and Rodrigo, {A S} and Montiel, {M N} and Low, {J N} and C Glidewell",

year = "2006",

month = mar,

doi = "10.1107/S0108270106003805",

language = "English",

volume = "62",

journal = "Acta Crystallographica Section C-Crystal Structure Communications",

issn = "1600-5759",

publisher = "International Union of Crystallography",

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T1 - 4,5,6-triamino-2-(methylsulfanyl)pyrimidine: pi-stacked hydrogen-bonded sheets of R-2(2)(8), R-2(2)(10) and R-6(6)(32) rings

AU - Cobo, J

AU - Rodrigo, A S

AU - Montiel, M N

AU - Low, J N

AU - Glidewell, C

PY - 2006/3

Y1 - 2006/3

N2 - In the title compound, C5H9N5S, the three independent C-NH2 units are all somewhat pyramidal. The molecules are linked by a combination of one N-H center dot center dot center dot S and two N-H center dot center dot center dot N hydrogen bonds into sheets containing three types of ring motif, viz. R-2(2)(8), R-2(2)(10) and R-6(6)(32), all of them centrosymmetric. Adjacent sheets are linked by a single pi-pi stacking interaction.

AB - In the title compound, C5H9N5S, the three independent C-NH2 units are all somewhat pyramidal. The molecules are linked by a combination of one N-H center dot center dot center dot S and two N-H center dot center dot center dot N hydrogen bonds into sheets containing three types of ring motif, viz. R-2(2)(8), R-2(2)(10) and R-6(6)(32), all of them centrosymmetric. Adjacent sheets are linked by a single pi-pi stacking interaction.

KW - X-RAY

KW - DIFFRACTION

U2 - 10.1107/S0108270106003805

DO - 10.1107/S0108270106003805

M3 - Article

SN - 1600-5759

VL - 62

JO - Acta Crystallographica Section C-Crystal Structure Communications

JF - Acta Crystallographica Section C-Crystal Structure Communications

ER -

4,5,6-triamino-2-(methylsulfanyl)pyrimidine: pi-stacked hydrogen-bonded sheets of R-2(2)(8), R-2(2)(10) and R-6(6)(32) rings

Abstract

Keywords

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