Molecule:100786: Difference between revisions

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molecule
(auto-generated)
 
(auto-generated)
Line 8: Line 8:
|moleculeKey=NLKWUAXOGCKGEY-UHFFFAOYSA-L
|moleculeKey=NLKWUAXOGCKGEY-UHFFFAOYSA-L
|molOrRxn=
|molOrRxn=
   -INDIGO-08112312452D
   -INDIGO-08112312532D


   0  0  0  0  0  0  0  0  0  0  0 V3000
   0  0  0  0  0  0  0  0  0  0  0 V3000
Line 97: Line 97:
M  V30 END CTAB
M  V30 END CTAB
M  END
M  END
|smiles=C1C2C3C=CC=C4C5C=CC=C6C7C=CC=CN=7[Fe+2](O)(O)(N=34)(N=56)N=2C=CC=1.Cl([O-])(=O)(=O)=O.Cl([O-])(=O)(=O)=O
|smiles=C1C2C3C=CC=C4C5C=CC=C6C7C=CC=CN=7[Fe+2](O)(O)(N=34)(N=56)N=2C=CC=1.Cl([O-])(=O)(=O)=O.Cl([O-])(=O)(=O)=O
|inchi=1S/C20H14N4.2ClHO4.Fe.2H2O/c1-3-13-21-15(7-1)17-9-5-11-19(23-17)20-12-6-10-18(24-20)16-8-2-4-14-22-16;2*2-1(3,4)5;;;/h1-14H;2*(H,2,3,4,5);;2*1H2/q;;;+2;;/p-2
|inchi=1S/C20H14N4.2ClHO4.Fe.2H2O/c1-3-13-21-15(7-1)17-9-5-11-19(23-17)20-12-6-10-18(24-20)16-8-2-4-14-22-16;2*2-1(3,4)5;;;/h1-14H;2*(H,2,3,4,5);;2*1H2/q;;;+2;;/p-2

Revision as of 11:57, 11 August 2023

Properties
CID n/a
CAS n/a
IUPAC-Name n/a
Abbreviation n/a
Trivialname n/a
Exact mass 599.974935636
Molecular formula C20H18Cl2FeN4O10
LogP n/a
Has vendors n/a
Molecular role n/a
Synonyms n/a

[Fe(qpy)(H2O)2][ClO4]2


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