Monomers

Stilbene

Identifiers

IUPAC name
stilbene
InchI
InChI=1S/C14H12/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14/h1-12H
InchI Key
PJANXHGTPQOBST-UHFFFAOYSA-N
SMILES
c1ccc(cc1)C=Cc1ccccc1
Canonical SMILES
C1=CC=C(C=C1)C=CC2=CC=CC=C2
Isomeric SMILES
C1=CC=C(C=C1)C=CC2=CC=CC=C2
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C14H12
Heavy Atom Count
14
Molecular Weight
180.25
Exact Molecular Weight
180.0939
Valence Electrons
68
Radical Electrons
0
tPSA
0.0
MolLogP
3.857
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
2
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
2

MOL File


     RDKit          3D

 26 27  0  0  0  0  0  0  0  0999 V2000
    4.6072    0.0941   -0.1056 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8100    1.0379    0.4929 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4383    0.8829    0.4476 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8677   -0.1884   -0.1797 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7281   -1.1207   -0.7734 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0945   -1.0084   -0.7537 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4083   -0.4156   -0.2656 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4165    0.4319    0.2757 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8651    0.2101    0.1927 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4289   -0.8656   -0.4377 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8171   -1.0551   -0.5032 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6231   -0.1170    0.0923 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0865    0.9754    0.7337 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7292    1.1412    0.7860 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6772    0.2286   -0.0621 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2430    1.9148    1.0076 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8103    1.6400    0.9273 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2901   -1.9898   -1.2832 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7417   -1.7555   -1.2281 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0828   -1.3079   -0.7933 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0788    1.3158    0.7980 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8090   -1.6203   -0.9157 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2063   -1.9265   -1.0162 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7074   -0.2337    0.0600 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7361    1.7290    1.2121 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2949    2.0029    1.2915 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  4  7  1  0
  7  8  2  3
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
  6  1  1  0
 14  9  1  0
  1 15  1  0
  2 16  1  0
  3 17  1  0
  5 18  1  0
  6 19  1  0
  7 20  1  0
  8 21  1  0
 10 22  1  0
 11 23  1  0
 12 24  1  0
 13 25  1  0
 14 26  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers