Dataset
X-ray diffraction (XRD)
Chemical Info
InChI | InChI=1S/2C16H10N6O4.2C6H12N2.4C2H4O2.8Cu/c2*17-21-19-13-7-11(15(23)24)5-3-9(13)1-2-10-4-6-12(16(25)26)8-14(10)20-22-18;2*1-2-8-5-3-7(1)4-6-8;4*1-2(3)4;;;;;;;;/h2*1-8H,(H,23,24)(H,25,26);2*1-6H2;4*1H3,(H,3,4);;;;;;;;/p-8/b2*2-1+;;;;;;;;;;;;;; |
---|---|
SMILES | C1CN2CCN1CC2.C1CN2CCN1CC2.[O-]C(=O)C.[O-]C(=O)C.[O-]C(=O)C.[O-]C(=O)C.[N-]=[N+]=Nc1cc(ccc1/C=C/c1ccc(cc1N=[N+]=[N-])C(=O)[O-])C(=O)[O-].[N-]=[N+]=Nc1cc(ccc1/C=C/c1ccc(cc1N=[N+]=[N-])C(=O)[O-])C(=O)[O-].[Cu][Cu].[Cu][Cu].[Cu][Cu].[Cu][Cu] |
InChI Key | DBLYDXDFRQUSRQ-QYQCSXRTSA-F |
Molecular Formula | C52H52Cu8N16O16-8 |
Exact Mass | 1650.400 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/DBLYDXDFRQUSRQ-QYQCSXRTSA-F/CHMO0000156.15 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/DBLYDXDFRQUSRQ-QYQCSXRTSA-F/CHMO0000156.15 |
Version | |
Author | Lena Pilz |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T01:32:29.504539 |
MetadataModified | 2024-09-08T01:32:29.504545 |
MetadataPublished | 2023-09-07 |
Field | Value |
---|---|
Measurement Technique | X-ray diffraction |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
No additional information available for this Dataset. |