Molecule:100827: Difference between revisions
From ChemWiki
molecule
(auto-generated) |
No edit summary |
||
| Line 1: | Line 1: | ||
{{Molecule | {{Molecule | ||
|abbrev=[Ni(py)-(MeNHC)2(MeCN)][PF6]2 | |||
|abbrev= | |||
|molecularFormula=C<sub>15</sub>H<sub>20</sub>F<sub>12</sub>N<sub>6</sub>NiP<sub>2</sub> | |molecularFormula=C<sub>15</sub>H<sub>20</sub>F<sub>12</sub>N<sub>6</sub>NiP<sub>2</sub> | ||
|molecularMass=632.03864944 | |molecularMass=632.03864944 | ||
|moleculeKey=XLAXHWSGDXWDSW-UHFFFAOYSA-N | |moleculeKey=XLAXHWSGDXWDSW-UHFFFAOYSA-N | ||
|molOrRxn= | |molOrRxn=-INDIGO-11282314472D | ||
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 93: | Line 89: | ||
M V30 END CTAB | M V30 END CTAB | ||
M END | M END | ||
|smiles=C1C2N3C=CN(C)C3[Ni+2](N#CC)3C4N(C(N=23)=CC=1)C=CN4C.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F | |smiles=C1C2N3C=CN(C)C3[Ni+2](N#CC)3C4N(C(N=23)=CC=1)C=CN4C.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F | ||
|inchi=1S/C13H17N5.C2H3N.2F6P.Ni/c1-15-6-8-17(10-15)12-4-3-5-13(14-12)18-9-7-16(2)11-18;1-2-3;2*1-7(2,3,4,5)6;/h3-9H,10-11H2,1-2H3;1H3;;;/q;;2*-1;+2 | |inchi=1S/C13H17N5.C2H3N.2F6P.Ni/c1-15-6-8-17(10-15)12-4-3-5-13(14-12)18-9-7-16(2)11-18;1-2-3;2*1-7(2,3,4,5)6;/h3-9H,10-11H2,1-2H3;1H3;;;/q;;2*-1;+2 | ||
| Line 100: | Line 95: | ||
|height=200px | |height=200px | ||
|float=none | |float=none | ||
}} | }} | ||
Revision as of 14:48, 28 November 2023
| Properties | |
|---|---|
| CID | n/a |
| CAS | n/a |
| IUPAC-Name | n/a |
| Abbreviation | [Ni(py)-(MeNHC)2(MeCN)][PF6]2 |
| Trivialname | n/a |
| Exact mass | 632.03864944 |
| Molecular formula | C15H20F12N6NiP2 |
| 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
investigation
