Molecule FYI-1007201

Home > Molecule

A

Molecule Summary:

ID: FYI-1007201
Names:
InChIKey: OJAWOLWHEQUTDE-UHFFFAOYSA-N
SMILES: Cc1cn(C)nn1

Received at FYIcenter.com on: 2024-02-07

Molecule ID: FYI-1007201 Edit

Molecule Structure InChIKey: OJAWOLWHEQUTDE-UHFFFAOYSA-N

Molecule Structure SMILES String: Cc1cn(C)nn1

Download SDF Download SVG Structure in 2D SDF:

FYI-1007201
FYIcenter.com

  7  7  0  0  0  0  0  0  0  0999 V2000
    3.1641    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5967    1.3315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4641    2.1544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3315    1.3315    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7641    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.7641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9282    1.7641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  1  2  0  0  0  0
  4  6  1  0  0  0  0
  2  7  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1007201-3D
FYIcenter.com

 14 14  0     0  0  0  0  0  0999 V2000
    1.0709   -0.1525   -0.0014 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6844    1.1335   -0.0001 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6440    1.1461    0.0002 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0765   -0.1510   -0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0039   -0.9972   -0.0012 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4693   -0.4999    0.0018 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5079   -0.4790    0.0014 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0998   -2.0738   -0.0009 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5736   -1.5877    0.0006 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9310   -0.0793   -0.8948 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9263   -0.0817    0.9020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0011   -0.0433   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6723   -1.5610   -0.0213 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9896   -0.0816    0.9001 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  6  9  1  0  0  0  0
  6 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2024-02-18, 1752👍, 0💬