Molecule:100717: Difference between revisions

From ChemWiki
molecule
No edit summary
No edit summary
 
(7 intermediate revisions by one other user not shown)
Line 1: Line 1:
{{Molecule
{{Molecule
|abbrev=Mn(CN)(bpy)(CO)3
|abbrev=Mn(CN)(bpy)(CO)3
|molecularFormula=C<sub>14</sub>H<sub>12</sub>MnN<sub>3</sub>O<sub>3</sub>
|molecular_role=catalyst
|molecularMass=325.025911344
|moleculeKey=PZMFAIZJHXCGTO-UHFFFAOYSA-N
|moleculeKey=UTEWKQPZQFNRSL-UHFFFAOYSA-N
|molOrRxn=-INDIGO-01102416302D
|molOrRxn=-INDIGO-03292312002D


   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 22: Line 21:
M  V30 11 C 3.73771 -6.35308 0.0 0
M  V30 11 C 3.73771 -6.35308 0.0 0
M  V30 12 C 3.74417 -7.35314 0.0 0
M  V30 12 C 3.74417 -7.35314 0.0 0
M  V30 13 Mn 6.4 -5.375 0.0 0
M  V30 13 Mn 6.4 -5.375 0.0 0 CHG=1
M  V30 14 C 6.4 -4.375 0.0 0
M  V30 14 C 6.4 -4.375 0.0 0 CHG=-1
M  V30 15 C 7.10711 -4.66789 0.0 0
M  V30 15 C 7.10711 -4.66789 0.0 0 CHG=-1
M  V30 16 C 7.26603 -5.875 0.0 0
M  V30 16 C 7.26603 -5.875 0.0 0 CHG=-1
M  V30 17 C 6.4 -6.375 0.0 0
M  V30 17 C 6.4 -6.375 0.0 0 CHG=-1
M  V30 18 O 6.4 -3.375 0.0 0
M  V30 18 O 6.4 -3.375 0.0 0 CHG=1
M  V30 19 O 7.81421 -3.96079 0.0 0
M  V30 19 O 7.81421 -3.96079 0.0 0 CHG=1
M  V30 20 O 8.13205 -6.375 0.0 0
M  V30 20 O 8.13205 -6.375 0.0 0 CHG=1
M  V30 21 N 6.4 -7.375 0.0 0
M  V30 21 N 6.4 -7.375 0.0 0
M  V30 END ATOM
M  V30 END ATOM
Line 59: Line 58:
M  V30 END CTAB
M  V30 END CTAB
M  END
M  END
|smiles=C1C=C2C3C=CC=CN=3[Mn](C#N)(C#O)(C#O)(C#O)N2=CC=1
|smiles=C1C=C2C3C=CC=CN=3[Mn+]([C-]#N)([C-]#[O+])([C-]#[O+])([C-]#[O+])N2=CC=1
|inchi=1S/C10H8N2.CHN.3CHO.Mn/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;4*1-2;/h1-8H;4*1H;
|inchi=1S/C10H8N2.CN.3CO.Mn/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;4*1-2;/h1-8H;;;;;/q;-1;;;;+1
|inchikey=UTEWKQPZQFNRSL-UHFFFAOYSA-N
|inchikey=PZMFAIZJHXCGTO-UHFFFAOYSA-N
|width=300px
|width=200
|height=UTEWKQPZQFNRSL-UHFFFAOYSA-N
|height=200
|float=none
|float=none
}}
}}

Latest revision as of 14:13, 6 September 2024

Properties
CID n/a
CAS n/a
IUPAC-Name n/a
Abbreviation Mn(CN)(bpy)(CO)3
Trivialname n/a
Exact mass n/a
Molecular formula n/a
LogP n/a
Has vendors n/a
Molecular role catalyst
Synonyms n/a

Mn(CN)(bpy)(CO)3


Click here to copy MOL-file.
Click here to show SMILES and InChI.

Molecule is used on following pages

topic
publication
investigation