Molecule FYI-1015299

A

Molecule Summary:

ID: FYI-1015299
Names:
InChIKey: GXAVRTZLZLHHQM-UHFFFAOYSA-L
SMILES: Cl[Ru@](Cl)([n+]1cc[nH]c1)[n+]2cc[nH]c2

Received at FYIcenter.com on: 2025-08-02

Molecule ID: FYI-1015299 Edit

Molecule Structure InChIKey: GXAVRTZLZLHHQM-UHFFFAOYSA-L

Molecule Structure SMILES String: Cl[Ru@](Cl)([n+]1cc[nH]c1)[n+]2cc[nH]c2

Download SDF Download SVG Structure in 2D SDF:

FYI-1015299
FYIcenter.com

 13 14  0  0  0  0  0  0  0  0999 V2000
    1.3950    3.5576    0.0000 Ru  0  0  0  0  0  0  0  0  0  0  0  0
    1.3950    4.9576    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.4015    2.1576    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.2728    1.3295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7116    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1116    0.0065    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5380    1.3400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5276    5.7805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0950    7.1120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6950    7.1120    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2624    5.7805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.4398    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.7881    3.4180    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  3  7  2  0  0  0  0
  3  4  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
  2 11  2  0  0  0  0
  2  8  1  0  0  0  0
  1 12  1  1  0  0  0
  1 13  1  1  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015299-3D
FYIcenter.com

 21 22  0  0  0  0  0  0  0  0999 V2000
    1.4044   -0.9589    0.6654 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.3091    0.2782   -0.1387 Ru  0  0  0  0  0  0  0  0  0  0  0  0
    5.1614    1.6330   -0.8707 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.2653   -0.1476    1.7134 N   0  3  0  0  0  0  0  0  0  0  0  0
    5.0132   -1.2179    2.0352 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4111   -1.0795    3.3513 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9067    0.0746    3.8304 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2145    0.6225    2.8146 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1032   -1.4610   -1.1159 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.5812   -2.7030   -1.1143 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3825   -3.5141   -1.8889 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3984   -2.7749   -2.3668 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2103   -1.5318   -1.8844 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2477   -2.0364    1.3713 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0195   -1.7689    3.9200 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0261    0.4619    4.7915 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6802    1.5617    2.8782 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6823   -3.0071   -0.6006 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2330   -4.5659   -2.0954 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1709   -3.0980   -2.9893 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8659   -0.7028   -2.1029 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  9  1  0  0  0  0
  4  5  1  0  0  0  0
  4  8  2  0  0  0  0
  5  6  2  0  0  0  0
  5 14  1  0  0  0  0
  6  7  1  0  0  0  0
  6 15  1  0  0  0  0
  7  8  1  0  0  0  0
  7 16  1  0  0  0  0
  8 17  1  0  0  0  0
  9 10  1  0  0  0  0
  9 13  2  0  0  0  0
 10 11  2  0  0  0  0
 10 18  1  0  0  0  0
 11 12  1  0  0  0  0
 11 19  1  0  0  0  0
 12 13  1  0  0  0  0
 12 20  1  0  0  0  0
 13 21  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2025-08-18, 479👍, 0💬