Molecule:100815: Difference between revisions
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molecule
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{{Molecule | {{Molecule | ||
|abbrev=[Ni(dMecyclam)]2[TfO]4 | |||
|abbrev= | |||
|molecularFormula=C<sub>28</sub>H<sub>54</sub>F<sub>12</sub>N<sub>8</sub>Ni<sub>2</sub>O<sub>12</sub>S<sub>4</sub> | |molecularFormula=C<sub>28</sub>H<sub>54</sub>F<sub>12</sub>N<sub>8</sub>Ni<sub>2</sub>O<sub>12</sub>S<sub>4</sub> | ||
|molecularMass=1166.125927608 | |molecularMass=1166.125927608 | ||
|moleculeKey=WTJGMZBJEKJYKL-UHFFFAOYSA-J | |moleculeKey=WTJGMZBJEKJYKL-UHFFFAOYSA-J | ||
|molOrRxn= | |molOrRxn= | ||
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M V30 END CTAB | M V30 END CTAB | ||
M END | M END | ||
|smiles=C(C)1C(C2C(C)N3CCN4[Ni+2]33N(CCN3CCC4)C2C)C(C)N2CCN3[Ni+2]22N(CCN12)CCC3.S(=O)(C(F)(F)F)([O-])=O.S(=O)(C(F)(F)F)([O-])=O.S(=O)(C(F)(F)F)([O-])=O.S(=O)(C(F)(F)F)([O-])=O | |smiles=C(C)1C(C2C(C)N3CCN4[Ni+2]33N(CCN3CCC4)C2C)C(C)N2CCN3[Ni+2]22N(CCN12)CCC3.S(=O)(C(F)(F)F)([O-])=O.S(=O)(C(F)(F)F)([O-])=O.S(=O)(C(F)(F)F)([O-])=O.S(=O)(C(F)(F)F)([O-])=O | ||
|inchi=1S/C24H54N8.4CHF3O3S.2Ni/c1-19-23(20(2)30-16-12-26-8-5-7-25-11-15-29-19)24-21(3)31-17-13-27-9-6-10-28-14-18-32-22(24)4;4*2-1(3,4)8(5,6)7;;/h19-32H,5-18H2,1-4H3;4*(H,5,6,7);;/q;;;;;2*+2/p-4 | |inchi=1S/C24H54N8.4CHF3O3S.2Ni/c1-19-23(20(2)30-16-12-26-8-5-7-25-11-15-29-19)24-21(3)31-17-13-27-9-6-10-28-14-18-32-22(24)4;4*2-1(3,4)8(5,6)7;;/h19-32H,5-18H2,1-4H3;4*(H,5,6,7);;/q;;;;;2*+2/p-4 | ||
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|height=200px | |height=200px | ||
|float=none | |float=none | ||
|trivialname= | |||
|synonyms= | |||
|hasVendors= | |||
|parent= | |parent= | ||
}} | }} | ||
Latest revision as of 16:07, 23 May 2024
| Properties | |
|---|---|
| CID | n/a |
| CAS | n/a |
| IUPAC-Name | n/a |
| Abbreviation | [Ni(dMecyclam)]2[TfO]4 |
| Trivialname | n/a |
| Exact mass | 1166.125927608 |
| Molecular formula | C28H54F12N8Ni2O12S4 |
| LogP | n/a |
| Has vendors | n/a |
| Molecular role | n/a |
| Synonyms | n/a |
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