Molecule:100812: Difference between revisions

From ChemWiki
molecule
(auto-generated)
Tags: Manual revert Reverted
(auto-generated)
Tag: Manual revert
 
Line 1: Line 1:
{{Molecule
{{Molecule
|abbrev=Ni(cyclam)Cl2
|abbrev=Ni(cyclam)Cl2
|molecularFormula=
|molecularFormula=C<sub>10</sub>H<sub>24</sub>Cl<sub>2</sub>N<sub>4</sub>Ni
|molecularMass=
|molecularMass=328.073145028
|moleculeKey=IZFLGDSTXHVTSZ-UHFFFAOYSA-L
|moleculeKey=IZFLGDSTXHVTSZ-UHFFFAOYSA-L
|molOrRxn=
|molOrRxn=
|smiles=
  -INDIGO-11272318242D
|inchi=
 
  0  0  0  0  0  0  0  0  0  0  0 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS 17 18 0 0 0
M  V30 BEGIN ATOM
M  V30 1 Cl 10.2 -3.675 0.0 0 CHG=-1
M  V30 2 Cl 6.15 -3.675 0.0 0 CHG=-1
M  V30 3 C 7.4 -3.6 0.0 0
M  V30 4 N 7.4 -4.6 0.0 0
M  V30 5 C 8.26603 -3.1 0.0 0
M  V30 6 C 9.13205 -3.6 0.0 0
M  V30 7 N 9.13205 -4.6 0.0 0
M  V30 8 N 9.13205 -6.33205 0.0 0
M  V30 9 C 9.13205 -7.33205 0.0 0
M  V30 10 C 8.26603 -7.83205 0.0 0
M  V30 11 C 7.4 -7.33205 0.0 0
M  V30 12 N 7.4 -6.33205 0.0 0
M  V30 13 Ni 8.20711 -5.45711 0.0 0 CHG=2
M  V30 14 C 10.073 -4.95882 0.0 0
M  V30 15 C 10.073 -5.95882 0.0 0
M  V30 16 C 6.53397 -4.95 0.0 0
M  V30 17 C 6.53397 -5.95 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 3 4
M  V30 2 1 3 5
M  V30 3 1 5 6
M  V30 4 1 6 7
M  V30 5 1 8 9
M  V30 6 1 9 10
M  V30 7 1 10 11
M  V30 8 1 11 12
M  V30 9 10 4 13
M  V30 10 10 13 7
M  V30 11 10 8 13
M  V30 12 10 13 12
M  V30 13 1 7 14
M  V30 14 1 14 15
M  V30 15 1 15 8
M  V30 16 1 4 16
M  V30 17 1 16 17
M  V30 18 1 17 12
M  V30 END BOND
M  V30 END CTAB
M  END
|smiles=C1CCN2CCN3[Ni+2]22N(CCN12)CCC3.[Cl-].[Cl-]
|inchi=1S/C10H24N4.2ClH.Ni/c1-3-11-7-9-13-5-2-6-14-10-8-12-4-1;;;/h11-14H,1-10H2;2*1H;/q;;;+2/p-2
|inchikey=IZFLGDSTXHVTSZ-UHFFFAOYSA-L
|inchikey=IZFLGDSTXHVTSZ-UHFFFAOYSA-L
|width=300px
|width=300px

Latest revision as of 16:07, 23 May 2024

Properties
CID n/a
CAS n/a
IUPAC-Name n/a
Abbreviation Ni(cyclam)Cl2
Trivialname n/a
Exact mass 328.073145028
Molecular formula C10H24Cl2N4Ni
LogP n/a
Has vendors n/a
Molecular role n/a
Synonyms n/a

Ni(cyclam)Cl2


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

Molecule is used on following pages

publication
investigation