2007
DOI: 10.1107/s1600536807010665
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Creatininium benzoate

Abstract: In the title compound, C4H8N3O+·C7H5O2−, the asymmetric unit comprises one creatininium cation and one benzoate anion. Inter­molecular N—H⋯O hydrogen bonds link the cations and anions into ion pairs, which are further linked into zigzag chains by other N—H⋯O hydrogen bonds. The crystal packing also exhibits weak inter­molecular C—H⋯O hydrogen bonds and dipole–dipole inter­actions.

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Cited by 11 publications
(18 citation statements)
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“…Protonation of the N site of the cation is evident from C-N bond distances and the C-N-C bond angle. Other bond distances and angles are comparable with those found in creatininium hydrogen maleate (Ali et al, 2011a), creatininium cinnamate (Ali et al, 2011b), creatininium hydrogen oxalate monohydrate , creatininium benzoate (Bahadur, Sivapragasam et al, 2007) and bis(creatininium) sulfate (Bahadur, Rajalakshmi et al, 2007). The deprotonation on the -COOH groups of the monochloroacetic acid is confirmed from the -COObond geometry.…”
Section: Related Literaturesupporting
confidence: 77%
See 1 more Smart Citation
“…Protonation of the N site of the cation is evident from C-N bond distances and the C-N-C bond angle. Other bond distances and angles are comparable with those found in creatininium hydrogen maleate (Ali et al, 2011a), creatininium cinnamate (Ali et al, 2011b), creatininium hydrogen oxalate monohydrate , creatininium benzoate (Bahadur, Sivapragasam et al, 2007) and bis(creatininium) sulfate (Bahadur, Rajalakshmi et al, 2007). The deprotonation on the -COOH groups of the monochloroacetic acid is confirmed from the -COObond geometry.…”
Section: Related Literaturesupporting
confidence: 77%
“…For related structures, see: Ali et al (2011a,b); ; Bahadur, Sivapragasam et al (2007); Bahadur, Rajalakshmi et al (2007). For hydrogen-bond motifs, see: Bernstein et al (1995).…”
Section: Related Literaturementioning
confidence: 99%
“…The protonation of the N site of the cation is evident from C-N bond distances. The values are comaparable with creatininium oxalate monohydrate , creatininium benzoate (Bahadur, Sivapragasam et al, 2007) and bis(creatininium) sulfate (Bahadur, Rajalakshmi et al, 2007). The deprotonation on the -COOH group of the cinnamic acid is confirmed from -COObond geometry.…”
Section: S1 Commentmentioning
confidence: 71%
“…For related structures, see: ; Bahadur, Sivapragasam et al (2007); Bahadur, Rajalakshmi et al (2007). For hydrogen-bonding motif notation, see: Bernstein et al (1995).…”
Section: Related Literaturementioning
confidence: 99%
“…For related structures see: Ali et al (2011a,b); ; Bahadur, Sivapragasam et al (2007); Bahadur, Rajalakshmi et al (2007). For hydrogen-bonding motifs, see Bernstein et al (1995).…”
Section: Related Literaturementioning
confidence: 97%