Crystal structure of 2-selenobenzyl-1-benzoic acid

Federico Martínez Ramos, Manuel Soriano-García

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Abstract

C14H12O2Se iS monoclinic, P21/c. Unit-cell dimensions at 293 K are a = 8.1055(7), b = 5.8403(11), c = 26.0302(17)Å, β = 94.560(5)°, V = 1228.3(3)Å3, Dx= 1.575 g/cm3, and Z = 4. The R value is 0.048 for 2144 observed reflections. The dihedral angle between the phenyl rings is 74.9(2)°. There is an intermolecular hydrogen bond between two symmetry related carboxyl groups with an O1⋯O2 distance of 2.668(6)Å. The molecules in the crystal are packed at normal van der Waals distances.
Original languageAmerican English
Pages (from-to)1349-1350
Number of pages2
JournalAnalytical Sciences
DOIs
StatePublished - 1 Sep 2003
Externally publishedYes

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Dihedral angle
Hydrogen bonds
Crystal structure
Crystals
Molecules
2-selenobenzyl-1-benzoic acid

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Martínez Ramos, Federico ; Soriano-García, Manuel. / Crystal structure of 2-selenobenzyl-1-benzoic acid. In: Analytical Sciences. 2003 ; pp. 1349-1350.
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title = "Crystal structure of 2-selenobenzyl-1-benzoic acid",
abstract = "C14H12O2Se iS monoclinic, P21/c. Unit-cell dimensions at 293 K are a = 8.1055(7), b = 5.8403(11), c = 26.0302(17){\AA}, β = 94.560(5)°, V = 1228.3(3){\AA}3, Dx= 1.575 g/cm3, and Z = 4. The R value is 0.048 for 2144 observed reflections. The dihedral angle between the phenyl rings is 74.9(2)°. There is an intermolecular hydrogen bond between two symmetry related carboxyl groups with an O1⋯O2 distance of 2.668(6){\AA}. The molecules in the crystal are packed at normal van der Waals distances.",
author = "{Mart{\'i}nez Ramos}, Federico and Manuel Soriano-Garc{\'i}a",
year = "2003",
month = "9",
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language = "American English",
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}

Crystal structure of 2-selenobenzyl-1-benzoic acid. / Martínez Ramos, Federico; Soriano-García, Manuel.

In: Analytical Sciences, 01.09.2003, p. 1349-1350.

Research output: Contribution to journalArticleResearchpeer-review

TY - JOUR

T1 - Crystal structure of 2-selenobenzyl-1-benzoic acid

AU - Martínez Ramos, Federico

AU - Soriano-García, Manuel

PY - 2003/9/1

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N2 - C14H12O2Se iS monoclinic, P21/c. Unit-cell dimensions at 293 K are a = 8.1055(7), b = 5.8403(11), c = 26.0302(17)Å, β = 94.560(5)°, V = 1228.3(3)Å3, Dx= 1.575 g/cm3, and Z = 4. The R value is 0.048 for 2144 observed reflections. The dihedral angle between the phenyl rings is 74.9(2)°. There is an intermolecular hydrogen bond between two symmetry related carboxyl groups with an O1⋯O2 distance of 2.668(6)Å. The molecules in the crystal are packed at normal van der Waals distances.

AB - C14H12O2Se iS monoclinic, P21/c. Unit-cell dimensions at 293 K are a = 8.1055(7), b = 5.8403(11), c = 26.0302(17)Å, β = 94.560(5)°, V = 1228.3(3)Å3, Dx= 1.575 g/cm3, and Z = 4. The R value is 0.048 for 2144 observed reflections. The dihedral angle between the phenyl rings is 74.9(2)°. There is an intermolecular hydrogen bond between two symmetry related carboxyl groups with an O1⋯O2 distance of 2.668(6)Å. The molecules in the crystal are packed at normal van der Waals distances.

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