Crystal structure of 4,6-diamino-2-(methylsulfanyl) pyridine-3-carbonitrile

Shaaban K. Mohamed, Kyle S. Knight, Mehmet Akkurt, Bahgat R M Hussein, Mustafa R. Albayati, Hiroyuki Ishida

Research output: Contribution to journalArticle

2 Citations (Scopus)

Abstract

The title pyrimidine derivative, C7H8N4S, is essentially planar, with a maximum deviation of 0.029 (2) Å from the mean plane of the non-H atoms. In the crystal, molecules are linked by an intermolecular bifurcated N - H⋯N hydrogen bond between the cyano N atom and the two amino groups, an N - H⋯N hydrogen bond between the two amino groups and a weak C - H⋯π interaction, forming a three-dimensional network.

Original languageEnglish
Pages (from-to)o197-0198
JournalActa Crystallographica Section E: Structure Reports Online
Volume71
Issue number3
DOIs
Publication statusPublished - Mar 1 2015

Fingerprint

Pyridine
pyridines
Hydrogen bonds
Crystal structure
hydrogen bonds
Atoms
crystal structure
pyrimidines
atoms
Derivatives
deviation
Crystals
Molecules
crystals
molecules
interactions
pyridine-3-carbonitrile
pyrimidine

Keywords

  • 4,6-diamino-2-(methylsulfanyl) pyridine-3-carbonitrile
  • Crystal structure
  • Multifunctional pyridines

ASJC Scopus subject areas

  • Condensed Matter Physics
  • Materials Science(all)
  • Chemistry(all)

Cite this

Crystal structure of 4,6-diamino-2-(methylsulfanyl) pyridine-3-carbonitrile. / Mohamed, Shaaban K.; Knight, Kyle S.; Akkurt, Mehmet; Hussein, Bahgat R M; Albayati, Mustafa R.; Ishida, Hiroyuki.

In: Acta Crystallographica Section E: Structure Reports Online, Vol. 71, No. 3, 01.03.2015, p. o197-0198.

Research output: Contribution to journalArticle

Mohamed, Shaaban K. ; Knight, Kyle S. ; Akkurt, Mehmet ; Hussein, Bahgat R M ; Albayati, Mustafa R. ; Ishida, Hiroyuki. / Crystal structure of 4,6-diamino-2-(methylsulfanyl) pyridine-3-carbonitrile. In: Acta Crystallographica Section E: Structure Reports Online. 2015 ; Vol. 71, No. 3. pp. o197-0198.
@article{07698f6d4e95463ea6ada64161b338bd,
title = "Crystal structure of 4,6-diamino-2-(methylsulfanyl) pyridine-3-carbonitrile",
abstract = "The title pyrimidine derivative, C7H8N4S, is essentially planar, with a maximum deviation of 0.029 (2) {\AA} from the mean plane of the non-H atoms. In the crystal, molecules are linked by an intermolecular bifurcated N - H⋯N hydrogen bond between the cyano N atom and the two amino groups, an N - H⋯N hydrogen bond between the two amino groups and a weak C - H⋯π interaction, forming a three-dimensional network.",
keywords = "4,6-diamino-2-(methylsulfanyl) pyridine-3-carbonitrile, Crystal structure, Multifunctional pyridines",
author = "Mohamed, {Shaaban K.} and Knight, {Kyle S.} and Mehmet Akkurt and Hussein, {Bahgat R M} and Albayati, {Mustafa R.} and Hiroyuki Ishida",
year = "2015",
month = "3",
day = "1",
doi = "10.1107/S2056989015003114",
language = "English",
volume = "71",
pages = "o197--0198",
journal = "Acta Crystallographica Section E: Structure Reports Online",
issn = "1600-5368",
publisher = "International Union of Crystallography",
number = "3",

}

TY - JOUR

T1 - Crystal structure of 4,6-diamino-2-(methylsulfanyl) pyridine-3-carbonitrile

AU - Mohamed, Shaaban K.

AU - Knight, Kyle S.

AU - Akkurt, Mehmet

AU - Hussein, Bahgat R M

AU - Albayati, Mustafa R.

AU - Ishida, Hiroyuki

PY - 2015/3/1

Y1 - 2015/3/1

N2 - The title pyrimidine derivative, C7H8N4S, is essentially planar, with a maximum deviation of 0.029 (2) Å from the mean plane of the non-H atoms. In the crystal, molecules are linked by an intermolecular bifurcated N - H⋯N hydrogen bond between the cyano N atom and the two amino groups, an N - H⋯N hydrogen bond between the two amino groups and a weak C - H⋯π interaction, forming a three-dimensional network.

AB - The title pyrimidine derivative, C7H8N4S, is essentially planar, with a maximum deviation of 0.029 (2) Å from the mean plane of the non-H atoms. In the crystal, molecules are linked by an intermolecular bifurcated N - H⋯N hydrogen bond between the cyano N atom and the two amino groups, an N - H⋯N hydrogen bond between the two amino groups and a weak C - H⋯π interaction, forming a three-dimensional network.

KW - 4,6-diamino-2-(methylsulfanyl) pyridine-3-carbonitrile

KW - Crystal structure

KW - Multifunctional pyridines

UR - http://www.scopus.com/inward/record.url?scp=84928106192&partnerID=8YFLogxK

UR - http://www.scopus.com/inward/citedby.url?scp=84928106192&partnerID=8YFLogxK

U2 - 10.1107/S2056989015003114

DO - 10.1107/S2056989015003114

M3 - Article

AN - SCOPUS:84928106192

VL - 71

SP - o197-0198

JO - Acta Crystallographica Section E: Structure Reports Online

JF - Acta Crystallographica Section E: Structure Reports Online

SN - 1600-5368

IS - 3

ER -