Molecule:100905: Difference between revisions
From ChemWiki
molecule
(auto-generated) |
(auto-generated) Tag: Manual revert |
||
(2 intermediate revisions by the same user not shown) | |||
Line 157: | Line 157: | ||
M V30 END CTAB | M V30 END CTAB | ||
M END | M END | ||
|smiles=N123CCN4CC5C=C(CN6[Co+2]78N9CC%10C=C(C=CC=%10)CN([Co+2]14N(CC1C=CC=C(CN7CCN8(CC6)CC9)C=1)CC2)CC3)C=CC=5.Cl(=O)([O-])(=O)=O.Cl(=O)([O-])(=O)=O.Cl(=O)([O-])(=O)=O.Cl(=O)([O-])(=O)=O | |smiles=N123CCN4CC5C=C(CN6[Co+2]78N9CC%10C=C(C=CC=%10)CN([Co+2]14N(CC1C=CC=C(CN7CCN8(CC6)CC9)C=1)CC2)CC3)C=CC=5.Cl(=O)([O-])(=O)=O.Cl(=O)([O-])(=O)=O.Cl(=O)([O-])(=O)=O.Cl(=O)([O-])(=O)=O | ||
|inchi=1S/C36H54N8.4ClHO4.2Co/c1-4-31-22-32(5-1)26-38-11-17-44-19-13-40-28-34-7-2-6-33(23-34)27-39-12-18-43(16-10-37-25-31)20-14-41-29-35-8-3-9-36(24-35)30-42-15-21-44;4*2-1(3,4)5;;/h1-9,22-24,37-42H,10-21,25-30H2;4*(H,2,3,4,5);;/q;;;;;2*+2/p-4 | |inchi=1S/C36H54N8.4ClHO4.2Co/c1-4-31-22-32(5-1)26-38-11-17-44-19-13-40-28-34-7-2-6-33(23-34)27-39-12-18-43(16-10-37-25-31)20-14-41-29-35-8-3-9-36(24-35)30-42-15-21-44;4*2-1(3,4)5;;/h1-9,22-24,37-42H,10-21,25-30H2;4*(H,2,3,4,5);;/q;;;;;2*+2/p-4 |
Latest revision as of 09:23, 6 May 2024
Properties | |
---|---|
CID | n/a |
CAS | n/a |
IUPAC-Name | n/a |
Abbreviation | n/a |
Trivialname | n/a |
Exact mass | 1112.107578368 |
Molecular formula | C36H54Cl4Co2N8O16 |
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
investigation