Crystallography Open Database





Information card for 2011735

2011734 << 2011735 >> 2011736

Preview



Coordinates

2011735.cif

Structure factors

2011735.hkl

Structure parameters

Common name Ferrocenylthiophene carboxylic acid
Formula - C15 H12 Fe O2 S -
Calculated formula - C15 H12 Fe O2 S -
Title of publication O-H...O, C-H...π(C~5~H~5~) intermolecular and C-H...O intramolecular interactions in 2-(ferrocenyl)thiophene-3-carboxylic acid
Authors of publication Gallagher, John F.; Hudson, Richard D. A.; Manning, A. R.
Journal of publication Acta Crystallographica, Section C
Year of publication 2001
Journal volume 57
Pages of publication 28 - 30
a 12.7108 ± 0.0008 Å
b 7.4801 ± 0.0006 Å
c 14.2397 ± 0.0009 Å
α 90°
β 110.542 ± 0.005°
γ 90°
Cell volume 1267.8 ± 0.15 Å3
Cell temperature 294 ± 1 K
Ambient diffraction temperature 294 ± 1 K
Number of distinct elements 5
Hermann-Mauguin symmetry space group P 1 21/a 1
Hall symmetry space group -P 2yab
Has coordinates Yes
Has disorder Yes
Has Fobs Yes

Top of the page