Molecule:100986: Difference between revisions
From ChemWiki
molecule
auto-generated |
auto-generated |
||
| (4 intermediate revisions by the same user not shown) | |||
| Line 2: | Line 2: | ||
|trivialname= | |trivialname= | ||
|abbrev= | |abbrev= | ||
|molecularFormula= | |molecularFormula= | ||
|molecularMass= | |molecularMass= | ||
|synonyms= | |synonyms= | ||
|hasVendors= | |hasVendors= | ||
| Line 178: | Line 178: | ||
M V30 END CTAB | M V30 END CTAB | ||
M END | M END | ||
|smiles=C1C2N3[Co]45N6C(=C(C7C=CC(=CC=7)S([O-])(=O)=O)C7=N4C(=C(C4C=CC(=CC=4)S([O-])(=O)=O)C4N5C(C=2C2C=CC(=CC=2)S([O-])(=O)=O)=CC=4)C=C7)C=CC=6C(C2C=CC(=CC=2)S([O-])(=O)=O)=C3C=1 | |smiles=C1C2N3[Co]45N6C(=C(C7C=CC(=CC=7)S([O-])(=O)=O)C7=N4C(=C(C4C=CC(=CC=4)S([O-])(=O)=O)C4N5C(C=2C2C=CC(=CC=2)S([O-])(=O)=O)=CC=4)C=C7)C=CC=6C(C2C=CC(=CC=2)S([O-])(=O)=O)=C3C=1 | ||
|inchi=1S/C44H28N4O12S4.Co/c49-61(50,51)29-9-1-25(2-10-29)41-33-17-19-35(45-33)42(26-3-11-30(12-4-26)62(52,53)54)37-21-23-39(47-37)44(28-7-15-32(16-8-28)64(58,59)60)40-24-22-38(48-40)43(36-20-18-34(41)46-36)27-5-13-31(14-6-27)63(55,56)57;/h1-24H,(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60);/q-2;+2/p-4/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-; | |inchi=1S/C44H28N4O12S4.Co/c49-61(50,51)29-9-1-25(2-10-29)41-33-17-19-35(45-33)42(26-3-11-30(12-4-26)62(52,53)54)37-21-23-39(47-37)44(28-7-15-32(16-8-28)64(58,59)60)40-24-22-38(48-40)43(36-20-18-34(41)46-36)27-5-13-31(14-6-27)63(55,56)57;/h1-24H,(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60);/q-2;+2/p-4/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-; | ||
Latest revision as of 11:44, 21 November 2025
| Properties | |
|---|---|
| CID | n/a |
| CAS | n/a |
| IUPAC-Name | n/a |
| Abbreviation | n/a |
| Trivialname | n/a |
| Exact mass | n/a |
| Molecular formula | n/a |
| LogP | n/a |
| Has vendors | n/a |
| Molecular role | n/a |
| Synonyms | n/a |
Click here to copy MOL-file.
Click here to show SMILES and InChI.
Molecule is used on following pages
publication
