Molecule:100788: Difference between revisions

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{{Molecule
{{Molecule
|abbrev=Co(qpy)(H2O)2(ClO4)2
|abbrev=[Co(qpy)(H2O)2][ClO4]2
|molecularFormula=C<sub>20</sub>H<sub>18</sub>Cl<sub>2</sub>CoN<sub>4</sub>O<sub>10</sub>
|molecularMass=602.973193136
|moleculeKey=OZQYFMFOIFRRLI-UHFFFAOYSA-L
|moleculeKey=OZQYFMFOIFRRLI-UHFFFAOYSA-L
|molOrRxn=-INDIGO-08112312532D
  0  0  0  0  0  0  0  0  0  0  0 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS 37 41 0 0 0
M  V30 BEGIN ATOM
M  V30 1 C 7.93029 25.0727 0.0 0
M  V30 2 C 9.46221 25.0731 0.0 0
M  V30 3 C 8.6977 25.5155 0.0 0
M  V30 4 C 9.46221 24.187 0.0 0
M  V30 5 C 7.93029 24.183 0.0 0
M  V30 6 N 8.69963 23.7447 0.0 0
M  V30 7 C 7.16484 23.7381 0.0 0
M  V30 8 C 6.40399 22.4085 0.0 0
M  V30 9 N 7.16775 22.8521 0.0 0
M  V30 10 C 5.63495 22.8488 0.0 0
M  V30 11 C 6.39273 24.1802 0.0 0
M  V30 12 C 5.63011 23.7303 0.0 0
M  V30 13 C 6.40673 21.5231 0.0 0
M  V30 14 C 7.17806 20.1996 0.0 0
M  V30 15 N 7.17556 21.0828 0.0 0
M  V30 16 C 6.41228 19.7536 0.0 0
M  V30 17 C 5.63789 21.0754 0.0 0
M  V30 18 C 5.64635 20.19 0.0 0
M  V30 19 C 7.94625 19.7594 0.0 0
M  V30 20 C 9.47817 19.7659 0.0 0
M  V30 21 N 8.7119 20.2052 0.0 0
M  V30 22 C 9.48169 18.8798 0.0 0
M  V30 23 C 7.94979 18.8697 0.0 0
M  V30 24 C 8.72087 18.4345 0.0 0
M  V30 25 Co 8.72177 22.0183 0.0 0 CHG=2
M  V30 26 O 9.88692 22.7708 0.0 0
M  V30 27 O 9.95332 21.2657 0.0 0
M  V30 28 Cl 12.3262 23.9218 0.0 0
M  V30 29 O 11.4408 23.9218 0.0 0
M  V30 30 O 12.334 24.7992 0.0 0
M  V30 31 O 13.2699 23.914 0.0 0
M  V30 32 O 12.3262 23.0365 0.0 0 CHG=-1
M  V30 33 Cl 12.397 21.0264 0.0 0
M  V30 34 O 11.4965 21.0264 0.0 0
M  V30 35 O 12.405 21.9188 0.0 0
M  V30 36 O 13.2665 21.0181 0.0 0
M  V30 37 O 12.397 20.1258 0.0 0 CHG=-1
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 2 3 1
M  V30 2 2 4 2
M  V30 3 1 1 5
M  V30 4 1 2 3
M  V30 5 2 5 6
M  V30 6 1 6 4
M  V30 7 1 5 7
M  V30 8 2 9 7
M  V30 9 2 10 8
M  V30 10 1 7 11
M  V30 11 1 8 9
M  V30 12 2 11 12
M  V30 13 1 12 10
M  V30 14 1 8 13
M  V30 15 2 15 13
M  V30 16 2 16 14
M  V30 17 1 13 17
M  V30 18 1 14 15
M  V30 19 2 17 18
M  V30 20 1 18 16
M  V30 21 1 14 19
M  V30 22 2 21 19
M  V30 23 2 22 20
M  V30 24 1 19 23
M  V30 25 1 20 21
M  V30 26 2 23 24
M  V30 27 1 24 22
M  V30 28 10 6 25
M  V30 29 10 25 21
M  V30 30 10 15 25
M  V30 31 10 25 9
M  V30 32 10 25 26
M  V30 33 10 25 27
M  V30 34 2 28 29
M  V30 35 2 28 30
M  V30 36 2 28 31
M  V30 37 1 28 32
M  V30 38 2 33 34
M  V30 39 2 33 35
M  V30 40 2 33 36
M  V30 41 1 33 37
M  V30 END BOND
M  V30 END CTAB
M  END
|smiles=C1C2C3C=CC=C4C5C=CC=C6C7C=CC=CN=7[Co+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[Co+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.Co.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.Co.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
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|height=200px
|height=200px
|float=none
|float=none
|trivialname=
|molecularFormula=
|molecularMass=
|synonyms=
|hasVendors=
|molOrRxn=
|parent=
}}
}}

Latest revision as of 10:05, 22 May 2024

Properties
CID n/a
CAS n/a
IUPAC-Name n/a
Abbreviation [Co(qpy)(H2O)2][ClO4]2
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

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


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