Molecule:100828: Difference between revisions

InChI	1S/2C56H50N2P2.2Cu.2F6P/c21-7-23-43(24-8-1)53-41-45(27-19-21-39-59(47-29-11-3-12-30-47)48-31-13-4-14-32-48)57-55-51(53)37-38-52-54(44-25-9-2-10-26-44)42-46(58-56(52)55)28-20-22-40-60(49-33-15-5-16-34-49)50-35-17-6-18-36-50;;;21-7(2,3,4,5)6/h21-18,23-26,29-38,41-42H,19-22,27-28,39-40H2;;;;/q;;2+1;2*-1
InChI-Key	LRXMZDJKCHDVRC-UHFFFAOYSA-N
SMILES	C(C1C=CC=CC=1)1C2C=CC3C(C4C=CC=CC=4)=CC4CCCCP(C5C=CC=CC=5)(C5C=CC=CC=5)[Cu+]56N7C8C9N5=C(CCCCP6(C5C=CC=CC=5)C5C=CC=CC=5)C=C(C5C=CC=CC=5)C=9C=CC=8C(C5C=CC=CC=5)=CC=7CCCCP(C5C=CC=CC=5)(C5C=CC=CC=5)[Cu+]56P(C7C=CC=CC=7)(C7C=CC=CC=7)CCCCC(C=1)=N5C=2C=3N=46.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F

Latest revision as of 12:33, 30 January 2024

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@@ Line 1: / Line 1: @@
 {{Molecule
-|trivialname=
+|abbrev=[Cu(phen)-(dPPh-Bu)2]2[PF6]2
-|abbrev=
+|molecularFormula=
-|molecularFormula=C<sub>112</sub>H<sub>100</sub>Cu<sub>2</sub>F<sub>12</sub>N<sub>4</sub>P<sub>6</sub>
+|molecularMass=
-|molecularMass=2040.47740262
-|synonyms=
-|hasVendors=
 |moleculeKey=LRXMZDJKCHDVRC-UHFFFAOYSA-N
 |molOrRxn=
@@ Line 311: / Line 308: @@
 M  V30 END CTAB
 M  END
 |smiles=C(C1C=CC=CC=1)1C2C=CC3C(C4C=CC=CC=4)=CC4CCCCP(C5C=CC=CC=5)(C5C=CC=CC=5)[Cu+]56N7C8C9N5=C(CCCCP6(C5C=CC=CC=5)C5C=CC=CC=5)C=C(C5C=CC=CC=5)C=9C=CC=8C(C5C=CC=CC=5)=CC=7CCCCP(C5C=CC=CC=5)(C5C=CC=CC=5)[Cu+]56P(C7C=CC=CC=7)(C7C=CC=CC=7)CCCCC(C=1)=N5C=2C=3N=46.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F
 |inchi=1S/2C56H50N2P2.2Cu.2F6P/c2*1-7-23-43(24-8-1)53-41-45(27-19-21-39-59(47-29-11-3-12-30-47)48-31-13-4-14-32-48)57-55-51(53)37-38-52-54(44-25-9-2-10-26-44)42-46(58-56(52)55)28-20-22-40-60(49-33-15-5-16-34-49)50-35-17-6-18-36-50;;;2*1-7(2,3,4,5)6/h2*1-18,23-26,29-38,41-42H,19-22,27-28,39-40H2;;;;/q;;2*+1;2*-1
@@ Line 318: / Line 314: @@
 |height=200px
 |float=none
+|trivialname=
+|synonyms=
+|hasVendors=
 |parent=
 }}