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Information card for entry 4089313
Preview
Coordinates | 4089313.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | compound 1Co |
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Formula | C31 H46 B Co2 N6 O4 |
Calculated formula | C31 H46 B Co2 N6 O4 |
SMILES | C(#[O])[Co](C#[O])(C#[O])([Co]12[n]3c(cc(C(C)C)n3[BH](n3c(cc(C(C)C)[n]13)C(C)C)n1c(cc(C(C)C)[n]21)C(C)C)C(C)C)C#[O] |
Title of publication | Rational Synthesis and Reversible Metal−Metal Bond Scission of Heterobimetallic Xenophilic Complexes Containing an Unsupported, Polar Metal−Metal Bond, TpiPr2M−Co(CO)3L (M = Ni, Co, Fe, Mn; L = CO, PPh3) |
Authors of publication | Uehara, Kazuhiro; Hikichi, Shiro; Akita, Munetaka |
Journal of publication | Organometallics |
Year of publication | 2001 |
Journal volume | 20 |
Journal issue | 24 |
Pages of publication | 5002 |
a | 18.9886 ± 0.0007 Å |
b | 17.0443 ± 0.0005 Å |
c | 11.0816 ± 0.0005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3586.5 ± 0.2 Å3 |
Cell temperature | 213 ± 2 K |
Ambient diffraction temperature | 213 ± 2 K |
Number of distinct elements | 6 |
Space group number | 62 |
Hermann-Mauguin space group symbol | P n m a |
Hall space group symbol | -P 2ac 2n |
Residual factor for all reflections | 0.0826 |
Residual factor for significantly intense reflections | 0.041 |
Weighted residual factors for significantly intense reflections | 0.1049 |
Weighted residual factors for all reflections included in the refinement | 0.1271 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.633 |
Diffraction radiation wavelength | 0.71069 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/4089313.html
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