Molecule:100498: Difference between revisions
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molecule
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(auto-generated) Tag: Manual revert |
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|moleculeKey=HPIOBCHPZVAATK-UHFFFAOYSA-N | |moleculeKey=HPIOBCHPZVAATK-UHFFFAOYSA-N | ||
|molOrRxn= | |molOrRxn= | ||
-INDIGO- | -INDIGO-11092309282D | ||
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 17: | Line 17: | ||
M V30 COUNTS 34 40 0 0 0 | M V30 COUNTS 34 40 0 0 0 | ||
M V30 BEGIN ATOM | M V30 BEGIN ATOM | ||
M V30 1 C | M V30 1 C 8.77818 -2.39419 0.0 0 | ||
M V30 2 C | M V30 2 C 9.56568 -3.90185 0.0 0 | ||
M V30 3 C | M V30 3 C 9.60456 -2.93752 0.0 0 | ||
M V30 4 C | M V30 4 C 8.61934 -4.37665 0.0 0 | ||
M V30 5 C | M V30 5 C 7.8904 -2.83774 0.0 0 | ||
M V30 6 C | M V30 6 C 7.82432 -3.83054 0.0 0 | ||
M V30 7 N | M V30 7 N 10.4405 -4.45572 0.0 0 | ||
M V30 8 C | M V30 8 C 10.3497 -5.46354 0.0 0 | ||
M V30 9 | M V30 9 N 8.53861 -5.38656 0.0 0 | ||
M V30 10 | M V30 10 C 9.40329 -5.92975 0.0 0 | ||
M V30 11 C | M V30 11 C 11.1475 -6.01893 0.0 0 | ||
M V30 12 C | M V30 12 C 11.0882 -6.99925 0.0 0 | ||
M V30 13 C | M V30 13 C 9.37194 -6.91346 0.0 0 | ||
M V30 14 C | M V30 14 C 10.2086 -7.44687 0.0 0 | ||
M V30 15 C | M V30 15 C 12.461 -2.5947 0.0 0 | ||
M V30 16 C | M V30 16 C 13.1563 -4.13947 0.0 0 | ||
M V30 17 C | M V30 17 C 13.2531 -3.16277 0.0 0 | ||
M V30 18 C | M V30 18 C 12.2464 -4.57663 0.0 0 | ||
M V30 19 C | M V30 19 C 11.5263 -2.99434 0.0 0 | ||
M V30 20 C | M V30 20 C 11.3871 -4.00797 0.0 0 | ||
M V30 21 C | M V30 21 C 14.1585 -2.75442 0.0 0 | ||
M V30 22 C | M V30 22 C 14.9626 -3.33191 0.0 0 | ||
M V30 23 C | M V30 23 C 13.9726 -4.713 0.0 0 | ||
M V30 24 C | M V30 24 C 14.8674 -4.30484 0.0 0 | ||
M V30 25 C | M V30 25 C 6.72327 -5.34925 0.0 0 | ||
M V30 26 C | M V30 26 C 7.54819 -6.86005 0.0 0 | ||
M V30 27 C | M V30 27 C 7.6063 -5.86467 0.0 0 | ||
M V30 28 C | M V30 28 C 6.65065 -7.33043 0.0 0 | ||
M V30 29 C | M V30 29 C 5.83784 -5.84193 0.0 0 | ||
M V30 30 C | M V30 30 C 5.81243 -6.82289 0.0 0 | ||
M V30 31 C | M V30 31 C 6.62929 -8.31067 0.0 0 | ||
M V30 32 C | M V30 32 C 5.77649 -8.78437 0.0 0 | ||
M V30 33 C | M V30 33 C 4.95434 -7.29437 0.0 0 | ||
M V30 34 C | M V30 34 C 4.93734 -8.28253 0.0 0 | ||
M V30 END ATOM | M V30 END ATOM | ||
M V30 BEGIN BOND | M V30 BEGIN BOND | ||
M V30 1 1 | M V30 1 2 3 1 | ||
M V30 2 2 2 | M V30 2 2 4 2 | ||
M V30 3 1 | M V30 3 1 1 5 | ||
M V30 4 2 | M V30 4 1 2 3 | ||
M V30 5 | M V30 5 2 5 6 | ||
M V30 6 | M V30 6 1 6 4 | ||
M V30 7 1 | M V30 7 1 8 7 | ||
M V30 8 1 | M V30 8 1 4 9 | ||
M V30 9 2 | M V30 9 1 7 2 | ||
M V30 10 1 9 10 | M V30 10 1 9 10 | ||
M V30 11 | M V30 11 2 10 8 | ||
M V30 12 | M V30 12 2 12 11 | ||
M V30 13 | M V30 13 1 10 13 | ||
M V30 14 1 | M V30 14 1 11 8 | ||
M V30 15 2 13 14 | M V30 15 2 13 14 | ||
M V30 16 1 14 | M V30 16 1 14 12 | ||
M V30 17 | M V30 17 2 17 15 | ||
M V30 18 | M V30 18 2 18 16 | ||
M V30 19 1 15 | M V30 19 1 15 19 | ||
M V30 20 | M V30 20 1 16 17 | ||
M V30 21 | M V30 21 2 19 20 | ||
M V30 22 | M V30 22 1 20 18 | ||
M V30 23 | M V30 23 2 22 21 | ||
M V30 24 | M V30 24 1 16 23 | ||
M V30 25 1 | M V30 25 1 21 17 | ||
M V30 26 2 | M V30 26 2 23 24 | ||
M V30 27 1 | M V30 27 1 24 22 | ||
M V30 28 | M V30 28 2 27 25 | ||
M V30 29 | M V30 29 2 28 26 | ||
M V30 30 | M V30 30 1 25 29 | ||
M V30 31 | M V30 31 1 26 27 | ||
M V30 32 | M V30 32 2 29 30 | ||
M V30 33 | M V30 33 1 30 28 | ||
M V30 34 | M V30 34 2 32 31 | ||
M V30 35 | M V30 35 1 30 33 | ||
M V30 36 1 | M V30 36 1 31 28 | ||
M V30 37 2 | M V30 37 2 33 34 | ||
M V30 38 1 32 | M V30 38 1 34 32 | ||
M V30 39 | M V30 39 1 9 27 | ||
M V30 40 1 | M V30 40 1 7 20 | ||
M V30 END BOND | M V30 END BOND | ||
M V30 END CTAB | M V30 END CTAB | ||
M END | M END | ||
|smiles= | |smiles=C1C=CC2N(C3C=C4C=CC=CC4=CC=3)C3C=CC=CC=3N(C3C=C4C=CC=CC4=CC=3)C=2C=1 | ||
|inchi=1S/C32H22N2/c1-3-11-25-21-27(19-17-23(25)9-1)33-29-13-5-7-15-31(29)34(32-16-8-6-14-30(32)33)28-20-18-24-10-2-4-12-26(24)22-28/h1-22H | |inchi=1S/C32H22N2/c1-3-11-25-21-27(19-17-23(25)9-1)33-29-13-5-7-15-31(29)34(32-16-8-6-14-30(32)33)28-20-18-24-10-2-4-12-26(24)22-28/h1-22H | ||
|inchikey=HPIOBCHPZVAATK-UHFFFAOYSA-N | |inchikey=HPIOBCHPZVAATK-UHFFFAOYSA-N |
Revision as of 11:53, 8 February 2024
Properties | |
---|---|
CID | 20767396 |
CAS | 1934269-97-2 |
IUPAC-Name | 5,10-dinaphthalen-2-ylphenazine |
Abbreviation | Phen1 |
Trivialname | 510-di(2-naphthyl)-510-dihydrophenazine |
Exact mass | 434.178298710 |
Molecular formula | C32H22N2 |
LogP | n/a |
Has vendors | true |
Molecular role | n/a |
Synonyms | 510-di(2-naphthyl)-510-dihydrophenazine,510-dinaphthalen-2-ylphenazine,phenn_2naph,schembl13886639,at25797,cs-0105666,j3.651.778f,510-di(naphthalen-2-yl)-510-dihydrophenazine,510-di(2-naphthyl)-510-dihydrophenazine >=97% |
5,10-Di(2-naphthyl)-5,10-dihydrophenazine
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