| SpectraBase Compound ID | IPnAOKVoMjm |
|---|---|
| InChI | InChI=1S/C44H72N12.2Ni/c1-2-6-10-18-46-30-42-35-51-23-15-27-55-39-44(40-56-28-16-24-52-36-42)32-48-20-12-8-4-3-7-11-19-47-31-43-37-53-25-13-21-49-33-41(29-45-17-9-5-1)34-50-22-14-26-54-38-43;;/h29-40,45-48H,1-28H2;;/q;2*+2/b41-29-,42-30-,43-31-,44-32-,49-33?,50-34?,51-35?,52-36?,53-37?,54-38?,55-39?,56-40?;; |
| InChIKey | YSURQDSLYDOEIR-YOBRBONCSA-N |
| Mol Weight | 886.5 g/mol |
| Molecular Formula | C44H72N12Ni2 |
| Exact Mass | 884.470974 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GbXDXi2Wt7g |
|---|---|
| Name | Octamethylene-bridged-dinickel complex |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C44H72N12Ni2 |
| InChI | InChI=1S/C44H72N12.2Ni/c1-2-6-10-18-46-30-42-35-51-23-15-27-55-39-44(40-56-28-16-24-52-36-42)32-48-20-12-8-4-3-7-11-19-47-31-43-37-53-25-13-21-49-33-41(29-45-17-9-5-1)34-50-22-14-26-54-38-43;;/h29-40,45-48H,1-28H2;;/q;2*+2/b41-29-,42-30-,43-31-,44-32-,49-33?,50-34?,51-35?,52-36?,53-37?,54-38?,55-39?,56-40?;; |
| InChIKey | YSURQDSLYDOEIR-YOBRBONCSA-N |
| Instrument Name | Bruker WP-80 |
| Literature Reference | D.H. Busch, G.G. Christoph, L.L.Zimmer, J. Am. Chem. Soc. 103, 5107 (1981). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CH3NO2 |