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Information card for entry 7011918
Preview
Coordinates | 7011918.cif |
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Original paper (by DOI) | HTML |
Chemical name | 8-(4'-ammonio-2'-thiabutyl)-8-methyl-1-oxa-6,10-dithia-3,13-diazacyclo- tetradecane(chloro)cobalt(III) triperchlorate trihydrate |
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Formula | C13 H36 Cl4 Co N3 O16 S3 |
Calculated formula | C13 H30 Cl4 Co N3 O16 S3 |
Title of publication | An unusual pendant-arm macrocycle formed by condensation of a cobalt(iii) tripodal complex with methanal |
Authors of publication | Angus, Patricia M.; Geue, Rodney J.; Jensen, Niels K. B.; Larsen, F. Krebs; Jin Qin, Chang; Sargeson, Alan M. |
Journal of publication | Journal of the Chemical Society, Dalton Transactions |
Year of publication | 2002 |
Journal issue | 22 |
Pages of publication | 4260 |
a | 8.0402 ± 0.0003 Å |
b | 32.169 ± 0.001 Å |
c | 11.859 ± 0.0004 Å |
α | 90° |
β | 109.662 ± 0.001° |
γ | 90° |
Cell volume | 2888.43 ± 0.17 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 7 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for significantly intense reflections | 0.064 |
Weighted residual factors for significantly intense reflections | 0.064 |
Goodness-of-fit parameter for significantly intense reflections | 1.29 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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