Molecule:100486: Difference between revisions

InChI	1S/3C10H8N2.Ru/c31-3-7-11-9(5-1)10-6-2-4-8-12-10;/h31-8H;
InChI-Key	BZSVVCFHMVMYCR-UHFFFAOYSA-N
SMILES	[Ru]1(~N2C=CC=CC=2C2=CC=CC=N2~1)1(~N2C=CC=CC=2C2=CC=CC=N2~1)1~N2C=CC=CC=2C2=CC=CC=N2~1

Properties
CID	3939621
CAS	n/a
IUPAC-Name	2-pyridin-2-ylpyridine;ruthenium
Abbreviation	Ru(bpy)3
Trivialname	tris(22'-bipyridine)ruthenium dichloride
Exact mass	570.110585
Molecular formula	C30H24N6Ru
LogP	n/a
Has vendors	true
Molecular role	n/a
Synonyms	tris(22'-bipyridine)ruthenium dichloride,cs-0082005

Revision as of 09:40, 24 March 2023

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Ru(bpy)3Cl2

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@@ Line 10: / Line 10: @@
 |moleculeKey=BZSVVCFHMVMYCR-UHFFFAOYSA-N
 |molOrRxn=
-   -INDIGO-01032317402D
+   -INDIGO-03242309392D
   0  0  0  0  0  0  0  0  0  0 V3000
@@ Line 16: / Line 16: @@
 M  V30 COUNTS 37 45 0 0 0
 M  V30 BEGIN ATOM
-M  V30 1 Ru 7.11592 -4.29237 0.0 0
+M  V30 1 Ru 0.0157762 -0.0172315 0.0 0
-M  V30 2 C 10.145 -2.59192 0.0 0
+M  V30 2 C 3.0449 1.68322 0.0 0
-M  V30 3 C 9.36392 -2.16269 0.0 0
+M  V30 3 C 2.26378 2.11245 0.0 0
-M  V30 4 C 8.60164 -2.62454 0.0 0
+M  V30 4 C 1.5015 1.6506 0.0 0
-M  V30 5 N 8.62047 -3.51563 0.0 0
+M  V30 5 N 1.52033 0.759516 0.0 0
-M  V30 6 C 9.40159 -3.94486 0.0 0
+M  V30 6 C 2.30145 0.330284 0.0 0
-M  V30 7 C 10.1639 -3.483 0.0 0
+M  V30 7 C 3.06373 0.792137 0.0 0
-M  V30 8 C 9.42042 -4.83594 0.0 0
+M  V30 8 C 2.32028 -0.560798 0.0 0
-M  V30 9 N 8.65814 -5.29779 0.0 0
+M  V30 9 N 1.558 -1.02265 0.0 0
-M  V30 10 C 8.67697 -6.18887 0.0 0
+M  V30 10 C 1.57683 -1.91373 0.0 0
-M  V30 11 C 9.45809 -6.61811 0.0 0
+M  V30 11 C 2.35795 -2.34297 0.0 0
-M  V30 12 C 10.2204 -6.15625 0.0 0
+M  V30 12 C 3.12023 -1.88111 0.0 0
-M  V30 13 C 10.2015 -5.26517 0.0 0
+M  V30 13 C 3.1014 -0.990029 0.0 0
-M  V30 14 C 4.05889 -2.39846 0.0 0
+M  V30 14 C -3.04125 1.87668 0.0 0
-M  V30 15 C 3.97991 -3.28624 0.0 0
+M  V30 15 C -3.12023 0.988903 0.0 0
-M  V30 16 C 4.70926 -3.79852 0.0 0
+M  V30 16 C -2.39088 0.476618 0.0 0
-M  V30 17 N 5.51758 -3.42303 0.0 0
+M  V30 17 N -1.58256 0.852109 0.0 0
-M  V30 18 C 5.59656 -2.53525 0.0 0
+M  V30 18 C -1.50358 1.73989 0.0 0
-M  V30 19 C 4.86721 -2.02297 0.0 0
+M  V30 19 C -2.23293 2.25217 0.0 0
-M  V30 20 C 6.40489 -2.15976 0.0 0
+M  V30 20 C -0.695254 2.11538 0.0 0
-M  V30 21 N 7.13424 -2.67205 0.0 0
+M  V30 21 N 0.0340945 1.60309 0.0 0
-M  V30 22 C 7.94256 -2.29656 0.0 0
+M  V30 22 C 0.842419 1.97858 0.0 0
-M  V30 23 C 8.02154 -1.40878 0.0 0
+M  V30 23 C 0.921397 2.86636 0.0 0
-M  V30 24 C 7.29219 -0.896501 0.0 0
+M  V30 24 C 0.192049 3.37864 0.0 0
-M  V30 25 C 6.48387 -1.27199 0.0 0
+M  V30 25 C -0.616276 3.00315 0.0 0
-M  V30 26 C 7.07924 -7.65378 0.0 0
+M  V30 26 C -0.0209014 -3.37864 0.0 0
-M  V30 27 C 7.85639 -7.2174 0.0 0
+M  V30 27 C 0.756244 -2.94226 0.0 0
-M  V30 28 C 7.86704 -6.32618 0.0 0
+M  V30 28 C 0.766898 -2.05104 0.0 0
-M  V30 29 N 7.10055 -5.87135 0.0 0
+M  V30 29 N 0.000406209 -1.59621 0.0 0
-M  V30 30 C 6.3234 -6.30773 0.0 0
+M  V30 30 C -0.776738 -2.03259 0.0 0
-M  V30 31 C 6.31275 -7.19895 0.0 0
+M  V30 31 C -0.787392 -2.92381 0.0 0
-M  V30 32 C 5.55691 -5.85289 0.0 0
+M  V30 32 C -1.54323 -1.57775 0.0 0
-M  V30 33 N 5.56756 -4.96168 0.0 0
+M  V30 33 N -1.53258 -0.686536 0.0 0
-M  V30 34 C 4.80107 -4.50684 0.0 0
+M  V30 34 C -2.29907 -0.2317 0.0 0
-M  V30 35 C 4.02393 -4.94323 0.0 0
+M  V30 35 C -3.07621 -0.668084 0.0 0
-M  V30 36 C 4.01327 -5.83444 0.0 0
+M  V30 36 C -3.08687 -1.5593 0.0 0
-M  V30 37 C 4.77976 -6.28928 0.0 0
+M  V30 37 C -2.32038 -2.01414 0.0 0
 M  V30 END ATOM
 M  V30 BEGIN BOND

Molecule:100486: Difference between revisions

Revision as of 09:40, 24 March 2023

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