Molecule FYI-1013607

Home > Molecule

A

Molecule Summary:

ID: FYI-1013607
Names:
InChIKey: UBUCNCOMADRQHX-UHFFFAOYSA-N
SMILES: O=NN(c1ccccc1)c2ccccc2

Received at FYIcenter.com on: 2025-01-16

Molecule ID: FYI-1013607 Edit

Molecule Structure InChIKey: UBUCNCOMADRQHX-UHFFFAOYSA-N

Molecule Structure SMILES String: O=NN(c1ccccc1)c2ccccc2

Download SDF Download SVG Structure in 2D SDF:

FYI-1013607
FYIcenter.com

 15 16  0  0  0  0  0  0  0  0999 V2000
    1.2125    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
  8 13  1  0  0  0  0
  8  9  2  0  0  0  0
  7 14  1  0  0  0  0
 14 15  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1013607-3D
FYIcenter.com

 25 26  0     0  0  0  0  0  0999 V2000
    1.0666    2.7737    0.0026 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0687    0.8582   -0.0229 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0518    2.2454    0.0159 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3130    0.1943   -0.0102 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2072    0.1435   -0.0116 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3599   -1.1996    0.0140 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7694   -0.1930   -1.2145 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4970    0.9318   -0.0223 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7711   -0.1512    1.2013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5906   -1.8560    0.0260 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9860   -0.8752   -1.2035 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7277    0.2753   -0.0103 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9877   -0.8333    1.2121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7744   -1.1186    0.0138 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5952   -1.1953    0.0097 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4668   -1.8169    0.0241 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2974    0.0549   -2.1598 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5155    2.0178   -0.0438 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3005    0.1285    2.1385 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6278   -2.9413    0.0447 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4589   -1.1571   -2.1397 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6501    0.8488   -0.0204 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4620   -1.0828    2.1568 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7326   -1.6297    0.0229 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5425   -1.7265    0.0182 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  4  6  2  0  0  0  0
  4  8  1  0  0  0  0
  5  7  2  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  6 16  1  0  0  0  0
  7 11  1  0  0  0  0
  7 17  1  0  0  0  0
  8 12  2  0  0  0  0
  8 18  1  0  0  0  0
  9 13  2  0  0  0  0
  9 19  1  0  0  0  0
 10 14  2  0  0  0  0
 10 20  1  0  0  0  0
 11 15  2  0  0  0  0
 11 21  1  0  0  0  0
 12 14  1  0  0  0  0
 12 22  1  0  0  0  0
 13 15  1  0  0  0  0
 13 23  1  0  0  0  0
 14 24  1  0  0  0  0
 15 25  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2025-02-16, 1222👍, 0💬