Information card for entry 2007325
Chemical name |
adduct of 1,10-Phenanthroline and 1,1'-Binaphthyl-2,2'-diol |
Formula |
C32 H22 N2 O2 |
Calculated formula |
C32 H22 N2 O2 |
SMILES |
n1cccc2c1c1ncccc1cc2.Oc1ccc2c(c1c1c(O)ccc3c1cccc3)cccc2 |
Title of publication |
Hydrogen Bonding in the 1:1 Adduct of 1,10-Phenanthroline and 1,1'-Binaphthyl-2,2'-diol |
Authors of publication |
García-Martínez, Emilia; Vázquez-López, Ezequiel M.; Tuck, Dennis G. |
Journal of publication |
Acta Crystallographica Section C |
Year of publication |
1998 |
Journal volume |
54 |
Journal issue |
6 |
Pages of publication |
840 - 842 |
a |
10.8768 ± 0.0015 Å |
b |
11.238 ± 0.002 Å |
c |
11.6786 ± 0.0008 Å |
α |
97.929 ± 0.008° |
β |
110.895 ± 0.007° |
γ |
109.635 ± 0.009° |
Cell volume |
1201 ± 0.3 Å3 |
Cell temperature |
293 ± 2 K |
Ambient diffraction temperature |
293 ± 2 K |
Number of distinct elements |
4 |
Space group number |
2 |
Hermann-Mauguin space group symbol |
P -1 |
Hall space group symbol |
-P 1 |
Residual factor for all reflections |
0.1 |
Residual factor for significantly intense reflections |
0.042 |
Weighted residual factors for all reflections included in the refinement |
0.129 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.016 |
Diffraction radiation wavelength |
1.54184 Å |
Diffraction radiation type |
CuKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
No |
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https://www.crystallography.net/2007325.html