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Information card for entry 7216970
Preview
Coordinates | 7216970.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C64.5 H83.5 N10 O20.25 |
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Calculated formula | C64.5 H82.25 N10 O20.25 |
Title of publication | Solid-state and solution studies of bis-carboxylate binding by bis-amidinium calix[4]arenes† |
Authors of publication | Camiolo, Salvatore; Gale, Philip A.; Ogden, Mark I.; Skelton, Brian W.; White, Allan H. |
Journal of publication | Journal of the Chemical Society, Perkin Transactions 2 |
Year of publication | 2001 |
Journal issue | 8 |
Pages of publication | 1294 |
a | 11.256 ± 0.004 Å |
b | 12.126 ± 0.005 Å |
c | 24.781 ± 0.009 Å |
α | 86.248 ± 0.006° |
β | 89.449 ± 0.006° |
γ | 85.085 ± 0.006° |
Cell volume | 3363 ± 2 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 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 | 0.113 |
Residual factor for significantly intense reflections | 0.068 |
Weighted residual factors for all reflections | 0.082 |
Weighted residual factors for all reflections included in the refinement | 0.072 |
Goodness-of-fit parameter for all reflections | 1.222 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.376 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7216970.html
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structural data.