Bis[1-(isopropylideneamino)guanidinium]bis(3-nitrobenzoate) monohydrate

Jan Skakle, Edward R. T. Tiekink, James L. Wardell, Solange M. S. V. Wardell

Research output: Contribution to journalArticle

Abstract

The asymmetric unit of the title salt hydrate, 2C(4)H(11)N(4)+center dot 2C(7)H(4)NO(4)(-)center dot H2O, comprises two independent 1-(isopropylideneamino)guanidinium cations, two independent 3-nitrobenzoate anions and a water molecule of crystallization. There are minimal geometric differences between the two planar [maximum deviations 0.061 (2) and 0.088 (2) angstrom] cations, and between the two almost planar anions [C-C-C-O and C-C-N-O torsion angles of 0.3 (3) and 11.1 (4)degrees, respectively in the first anion and -173.7 (2) and -0.1 (4), respectively in the second anion]. Extensive O-H center dot center dot center dot O and N-H center dot center dot center dot O hydrogen bonding between all components of the structure leads to the formation of a two-dimensional array with an undulating topology in the bc plane.

Original languageEnglish
Pages (from-to)o3221-o3222
Number of pages2
JournalActa Crystallographica Section E: Structure Reports Online
Volume65
Issue number12
DOIs
Publication statusPublished - Dec 2009

Cite this

Bis[1-(isopropylideneamino)guanidinium]bis(3-nitrobenzoate) monohydrate. / Skakle, Jan; Tiekink, Edward R. T.; Wardell, James L.; Wardell, Solange M. S. V.

In: Acta Crystallographica Section E: Structure Reports Online, Vol. 65, No. 12, 12.2009, p. o3221-o3222.

Research output: Contribution to journalArticle

Skakle, Jan ; Tiekink, Edward R. T. ; Wardell, James L. ; Wardell, Solange M. S. V. / Bis[1-(isopropylideneamino)guanidinium]bis(3-nitrobenzoate) monohydrate. In: Acta Crystallographica Section E: Structure Reports Online. 2009 ; Vol. 65, No. 12. pp. o3221-o3222.
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AB - The asymmetric unit of the title salt hydrate, 2C(4)H(11)N(4)+center dot 2C(7)H(4)NO(4)(-)center dot H2O, comprises two independent 1-(isopropylideneamino)guanidinium cations, two independent 3-nitrobenzoate anions and a water molecule of crystallization. There are minimal geometric differences between the two planar [maximum deviations 0.061 (2) and 0.088 (2) angstrom] cations, and between the two almost planar anions [C-C-C-O and C-C-N-O torsion angles of 0.3 (3) and 11.1 (4)degrees, respectively in the first anion and -173.7 (2) and -0.1 (4), respectively in the second anion]. Extensive O-H center dot center dot center dot O and N-H center dot center dot center dot O hydrogen bonding between all components of the structure leads to the formation of a two-dimensional array with an undulating topology in the bc plane.

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