Molecule FYI-1000279

Home > Molecule

A

Molecule Summary:

ID: FYI-1000279
SMILES: C[C@H](CCl)F

Received at FYIcenter.com on: 2021-03-03

Molecule ID: FYI-1000279 Edit

Molecule Structure SMILES String: C[C@H](CCl)F

Download SDF Download SVG Structure in 2D SDF:

FYI-1000279
FYIcenter.com

  5  4  0  0  1  0  0  0  0  0999 V2000
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  2  5  1  6  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1000279-3D
FYIcenter.com

 11 10  0  0  1  0  0  0  0  0999 V2000
    3.0743    1.1810    0.6357 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5129   -0.0439   -0.0672 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.0016   -0.0130   -0.2472 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4720    1.2872   -1.3390 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.8194   -1.1333    0.6989 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.1511    1.0601    0.7890 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6228    1.3007    1.6262 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9118    2.0966    0.0604 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0124   -0.1823   -1.0324 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6563   -0.9626   -0.6678 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4954    0.1183    0.7144 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  1  7  1  0  0  0  0
  1  8  1  0  0  0  0
  2  5  1  0  0  0  0
  2  3  1  0  0  0  0
  2  1  1  0  0  0  0
  2  9  1  6  0  0  0
  3  4  1  0  0  0  0
  3 10  1  0  0  0  0
  3 11  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2021-04-17, 2943👍, 0💬