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
1.3143 0.2274 0.6217 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4555 1.2288 0.6747 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7056 0.8562 -0.1508 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0346 0.0868 -1.2685 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7174 -0.8430 -0.2381 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4718 -1.3163 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3427 -0.3131 0.5246 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2678 0.2056 1.1161 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5787 2.1413 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3485 1.6190 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7517 0.7133 -1.7874 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6973 -0.4404 -1.8688 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3868 -1.5423 -0.6561 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6289 -2.2981 0.8795 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3119 -0.3251 0.9622 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