Molecule:100663: Difference between revisions
From ChemWiki
molecule
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{{Molecule | {{Molecule | ||
|abbrev=Ni(pbi)(pyS)2 | |abbrev=Ni(pbi)(pyS)2 | ||
|moleculeKey= | |moleculeKey=VEKXLADSICNUAQ-UHFFFAOYSA-L | ||
|molOrRxn= | |molOrRxn= | ||
-INDIGO- | -INDIGO-11302312452D | ||
0 0 0 0 0 0 0 0 0 0 0 V3000 | 0 0 0 0 0 0 0 0 0 0 0 V3000 | ||
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M V30 26 C 8.33576 -7.91156 0.0 0 | M V30 26 C 8.33576 -7.91156 0.0 0 | ||
M V30 27 C 8.93402 -8.69908 0.0 0 | M V30 27 C 8.93402 -8.69908 0.0 0 | ||
M V30 28 S | M V30 28 S 7.12277 -8.08302 0.0 0 CHG=-1 | ||
M V30 29 | M V30 29 Ni 7.04952 -6.51544 0.0 0 CHG=1 | ||
M V30 30 | M V30 30 S 6.97788 -5.00244 0.0 0 CHG=-1 | ||
M V30 END ATOM | M V30 END ATOM | ||
M V30 BEGIN BOND | M V30 BEGIN BOND | ||
| Line 70: | Line 70: | ||
M V30 28 2 26 27 | M V30 28 2 26 27 | ||
M V30 29 1 27 25 | M V30 29 1 27 25 | ||
M V30 30 1 | M V30 30 1 26 28 | ||
M V30 31 | M V30 31 10 20 29 | ||
M V30 32 10 | M V30 32 10 11 29 | ||
M V30 33 10 | M V30 33 10 2 29 | ||
M V30 34 10 | M V30 34 10 22 29 | ||
M V30 35 10 | M V30 35 10 28 29 | ||
M V30 36 | M V30 36 1 16 30 | ||
M V30 37 10 29 | M V30 37 10 30 29 | ||
M V30 END BOND | M V30 END BOND | ||
M V30 END CTAB | M V30 END CTAB | ||
M END | M END | ||
|smiles=C1C=CC=N2[Ni+ | |||
|inchi=1S/C12H9N3.2C5H5NS.Ni/c1-2-6-10-9(5-1)14-12(15-10)11-7-3-4-8-13-11;2*7-5-3-1-2-4-6-5;/h1-8H,(H,14,15);2*1-4H,(H,6,7);/q;;;+ | |smiles=C1C=CC=N2[Ni+]3([S-]C4N3=CC=CC=4)3([S-]C4=CC=CC=N43)N3=C(NC4C=CC=CC=43)C=12 | ||
|inchikey= | |inchi=1S/C12H9N3.2C5H5NS.Ni/c1-2-6-10-9(5-1)14-12(15-10)11-7-3-4-8-13-11;2*7-5-3-1-2-4-6-5;/h1-8H,(H,14,15);2*1-4H,(H,6,7);/q;;;+1/p-2 | ||
|inchikey=VEKXLADSICNUAQ-UHFFFAOYSA-L | |||
|width=300px | |width=300px | ||
|height=200px | |height=200px | ||
Revision as of 12:46, 30 November 2023
| Properties | |
|---|---|
| CID | n/a |
| CAS | n/a |
| IUPAC-Name | n/a |
| Abbreviation | Ni(pbi)(pyS)2 |
| Trivialname | n/a |
| Exact mass | 473.027880444 |
| Molecular formula | C22H17N5NiS2 |
| LogP | n/a |
| Has vendors | n/a |
| Molecular role | n/a |
| Synonyms | n/a |
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Molecule is used on following pages
topic
publication
- Visible-Light Photocatalytic Conversion of Carbon Dioxide by Ni(II) Complexes with N4S2 Coordination: Highly Efficient and Selective Production of Formate
- Photocatalytic Carbon Dioxide Reduction Using Nickel Complexes as Catalysts
investigation
