Molecule:100660: Difference between revisions
From ChemWiki
molecule
(auto-generated) |
(auto-generated) Tag: Reverted |
||
| Line 4: | Line 4: | ||
|moleculeKey=ZANCFLAGIYSVGM-UHFFFAOYSA-J | |moleculeKey=ZANCFLAGIYSVGM-UHFFFAOYSA-J | ||
|molOrRxn= | |molOrRxn= | ||
-INDIGO- | -INDIGO-01102414392D | ||
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 50: | Line 50: | ||
M V30 39 C 11.2066 -4.48571 0.0 0 | M V30 39 C 11.2066 -4.48571 0.0 0 | ||
M V30 40 C 14.3096 -6.85503 0.0 0 | M V30 40 C 14.3096 -6.85503 0.0 0 | ||
M V30 41 K 9. | M V30 41 K 9.875 -8.0 0.0 0 CHG=1 | ||
M V30 42 K | M V30 42 K 8.475 -7.95 0.0 0 CHG=1 | ||
M V30 END ATOM | M V30 END ATOM | ||
M V30 BEGIN BOND | M V30 BEGIN BOND | ||
| Line 104: | Line 104: | ||
M V30 END CTAB | M V30 END CTAB | ||
M END | M END | ||
|smiles=[Mo-2](=O)1(~SC2C3=NC4C=CC=CC=4N(C)C3OC(C)(C)C=2S~1)1~SC2C(C)(C)OC3N(C)C4C=CC=CC=4N=C3C=2S~1.[K+].[K+] | |smiles=[Mo-2](=O)1(~SC2C3=NC4C=CC=CC=4N(C)C3OC(C)(C)C=2S~1)1~SC2C(C)(C)OC3N(C)C4C=CC=CC=4N=C3C=2S~1.[K+].[K+] | ||
|inchi=1S/2C14H16N2OS2.2K.Mo.O/c2*1-14(2)12(19)11(18)10-13(17-14)16(3)9-7-5-4-6-8(9)15-10;;;;/h2*4-7,13,18-19H,1-3H3;;;;/q;;2*+1;+2;/p-4 | |inchi=1S/2C14H16N2OS2.2K.Mo.O/c2*1-14(2)12(19)11(18)10-13(17-14)16(3)9-7-5-4-6-8(9)15-10;;;;/h2*4-7,13,18-19H,1-3H3;;;;/q;;2*+1;+2;/p-4 | ||
Revision as of 14:40, 10 January 2024
| Properties | |
|---|---|
| CID | n/a |
| CAS | n/a |
| IUPAC-Name | n/a |
| Abbreviation | [K]2[MoO(Hqpdt)2] |
| Trivialname | n/a |
| Exact mass | 775.968546444 |
| Molecular formula | C28H32K2MoN4O3S4 |
| LogP | n/a |
| Has vendors | n/a |
| Molecular role | n/a |
| Synonyms | n/a |
Click here to copy MOL-file.
Click here to show SMILES and InChI.
Molecule is used on following pages
topic
publication
- Pyranopterin Related Dithiolene Molybdenum Complexes as Homogeneous Catalysts for CO2 Photoreduction
investigation
