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
    4.5456    0.7117   -0.4700 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8677    1.7886    0.0566 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5079    1.7279    0.2362 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7820    0.5802   -0.1081 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4773   -0.4828   -0.6318 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8593   -0.4283   -0.8172 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3430    0.5521    0.0964 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3531   -0.5064   -0.2172 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8007   -0.5467   -0.0162 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5066   -1.7155   -0.3719 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8601   -1.8151   -0.2084 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5655   -0.7564    0.3151 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8801    0.3801    0.6611 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4965    0.5082    0.5044 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6297    0.8016   -0.5969 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3767    2.7038    0.3416 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9712    2.5678    0.6482 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0215   -1.4095   -0.9294 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4039   -1.2582   -1.2264 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1038    1.4568    0.5204 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1124   -1.4014   -0.6402 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9491   -2.5506   -0.7850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3578   -2.7505   -0.5031 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6456   -0.8163    0.4533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3784    1.2422    1.0761 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0007    1.4167    0.7887 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