Dataset
proton-decoupled 31P nuclear magnetic resonance spectroscopy (31P{1H}-NMR)
Chemical Info
InChI | InChI=1S/2C36H28OP2.C6H4N2Se.2ClHO4.2Cu/c2*1-5-17-29(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;1-2-4-6-5(3-1)7-9-8-6;2*2-1(3,4)5;;/h2*1-28H;1-4H;2*(H,2,3,4,5);;/q;;;;;2*+1/p-2 |
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SMILES | c1ccc2c(c1)n[se]n2.c1ccc(cc1)P(c1ccccc1Oc1ccccc1P(c1ccccc1)c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1Oc1ccccc1P(c1ccccc1)c1ccccc1)c1ccccc1.[O-][Cl](=O)(=O)=O.[O-][Cl](=O)(=O)=O.[Cu+].[Cu+] |
InChI Key | MGDYVPDVFVURBP-UHFFFAOYSA-L |
Molecular Formula | C78H60Cl2Cu2N2O10P4Se |
Exact Mass | 1586.171 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/MGDYVPDVFVURBP-UHFFFAOYSA-L/CHMO0000889 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/MGDYVPDVFVURBP-UHFFFAOYSA-L/CHMO0000889 |
Version | |
Author | Valentina Ferraro |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T04:15:50.425342 |
MetadataModified | 2024-09-08T04:15:50.425348 |
MetadataPublished | 2024-07-23 |
Field | Value |
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Measurement Technique | proton-decoupled 31P nuclear magnetic resonance spectroscopy |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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No additional information available for this Dataset. |