Molecule:101025: Difference between revisions
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molecule
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|synonyms= | |synonyms= | ||
|hasVendors= | |hasVendors= | ||
|moleculeKey= | |moleculeKey=LJMJPPDEGWBXNM-UHFFFAOYSA-L | ||
|molOrRxn= | |molOrRxn= | ||
-INDIGO- | -INDIGO-04012615392D | ||
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 14: | Line 14: | ||
M V30 COUNTS 66 84 0 0 0 | M V30 COUNTS 66 84 0 0 0 | ||
M V30 BEGIN ATOM | M V30 BEGIN ATOM | ||
M V30 1 Cu 5.75017 -3.57471 0.0 0 CHG= | M V30 1 Cu 5.75017 -3.57471 0.0 0 CHG=2 | ||
M V30 2 Cu 9.59598 -3.57471 0.0 0 CHG= | M V30 2 Cu 9.59598 -3.57471 0.0 0 CHG=2 | ||
M V30 3 Cl 8.06512 -2.51083 0.0 0 CHG=-1 | M V30 3 Cl 8.06512 -2.51083 0.0 0 CHG=-1 | ||
M V30 4 Cl 7.24369 -4.63909 0.0 0 CHG=-1 | M V30 4 Cl 7.24369 -4.63909 0.0 0 CHG=-1 | ||
| Line 169: | Line 169: | ||
M V30 END CTAB | M V30 END CTAB | ||
M END | M END | ||
|smiles=[Cu+2]123(~N4=C(CN~1(CC1NC5C(N=1~2)=CC=CC=5)CC1NC2C(N=1~3)=CC=CC=2)NC1C4=CC=CC=1)1~[Cl-]~[Cu+2]234(~N(CC5NC6C(N=5~2)=CC=CC=6)(CC2NC5C(N=2~3)=CC=CC=5)CC2NC3C(N=2~4)=CC=CC=3)~[Cl-]~1 | |||
|smiles=[Cu+]123(~N4=C(CN~1(CC1NC5C(N=1~2)=CC=CC=5)CC1NC2C(N=1~3)=CC=CC=2)NC1C4=CC=CC=1)1~[Cl-]~[Cu+]234(~N(CC5NC6C(N=5~2)=CC=CC=6)(CC2NC5C(N=2~3)=CC=CC=5)CC2NC3C(N=2~4)=CC=CC=3)~[Cl-]~1 | |inchi=1S/2C24H21N7.2ClH.2Cu/c2*1-2-8-17-16(7-1)25-22(26-17)13-31(14-23-27-18-9-3-4-10-19(18)28-23)15-24-29-20-11-5-6-12-21(20)30-24;;;;/h2*1-12H,13-15H2,(H,25,26)(H,27,28)(H,29,30);2*1H;;/q;;;;2*+2/p-2 | ||
|inchi=1S/2C24H21N7.2ClH.2Cu/c2*1-2-8-17-16(7-1)25-22(26-17)13-31(14-23-27-18-9-3-4-10-19(18)28-23)15-24-29-20-11-5-6-12-21(20)30-24;;;;/h2*1-12H,13-15H2,(H,25,26)(H,27,28)(H,29,30);2*1H;;/q;;;;2*+ | |inchikey=LJMJPPDEGWBXNM-UHFFFAOYSA-L | ||
|inchikey= | |width=200 | ||
|width= | |height=200 | ||
|height= | |||
|float=none | |float=none | ||
|parent= | |parent= | ||
}} | }} | ||
Latest revision as of 15:40, 1 April 2026
| Properties | |
|---|---|
| CID | n/a |
| CAS | n/a |
| IUPAC-Name | n/a |
| Abbreviation | n/a |
| 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 |
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