Monomers

2,5-Norbornadiene

Identifiers

IUPAC name
bicyclo[2.2.1]hepta-2,5-diene
InchI
InChI=1S/C7H8/c1-2-7-4-3-6(1)5-7/h1-4,6-7H,5H2
InchI Key
SJYNFBVQFBRSIB-UHFFFAOYSA-N
SMILES
C1=CC2CC1C=C2
Canonical SMILES
C1C2C=CC1C=C2
Isomeric SMILES
C1C2C=CC1C=C2
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C7H8
Heavy Atom Count
7
Molecular Weight
92.141
Exact Molecular Weight
92.0626
Valence Electrons
36
Radical Electrons
0
tPSA
0.0
MolLogP
1.7485
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
2
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
2
Aromatic Rings
0

MOL File


     RDKit          3D

 15 16  0  0  0  0  0  0  0  0999 V2000
   -0.8421    1.1296   -0.5176 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2694    1.4231    0.1511 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8153    0.1729    0.7415 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5264   -0.5408    1.0265 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9902   -0.3469   -0.4300 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2147   -0.9367   -1.1115 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2840   -0.6515   -0.3827 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4588    1.8754   -1.0004 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7036    2.4064    0.2490 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4417    0.2730    1.5879 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1396    0.0165    1.7275 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3856   -1.5989    1.2259 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9202   -0.7678   -0.6686 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2382   -1.4985   -2.0323 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2961   -0.9559   -0.5663 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  5  1  1  0
  7  3  1  0
  1  8  1  0
  2  9  1  0
  3 10  1  0
  4 11  1  0
  4 12  1  0
  5 13  1  0
  6 14  1  0
  7 15  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers