13C nuclear magnetic resonance spectroscopy...
URL: https://doi.org/10.14272/APOKKEJOTUSELA-WNLPKAFNSA-N/CHMO0000595
Dataset description:
dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)
Source: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
Chemical Info
InChI | InChI=1S/C36H28OP2.C12H11N2S.Cu/c1-5-17-29(18-6-1)38(30-19-7-2-8-20-30)35-27-15-13-25-33(35)37-34-26-14-16-28-36(34)39(31-21-9-3-10-22-31)32-23-11-4-12-24-32;1-15-12-6-4-10(5-7-12)14-9-11-3-2-8-13-11;/h1-28H;2-9H,1H3;/q;-1;+1/b;14-9+; |
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SMILES | CSc1ccc(/N=C/c2ccc[n-]2)cc1.[Cu+].c1ccc(P(c2ccccc2)c2ccccc2Oc2ccccc2P(c2ccccc2)c2ccccc2)cc1 |
InChI Key | APOKKEJOTUSELA-WNLPKAFNSA-N |
Molecular Formula | C48H39CuN2OP2S |
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Additional Information
Field | Value |
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Data last updated | unknown |
Metadata last updated | April 20, 2024 |
Created | unknown |
Format | HTML |
License | Attribution 4.0 International (CC BY 4.0) |
Created | 1 month ago |
Id | d4368029-df65-4c36-804a-295a66dee8d9 |
Package id | 10-14272-apokkejotusela-wnlpkafnsa-n-chmo0000595 |
Resource type | HTML |
State | active |