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
-0.8162 1.0749 0.6052 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3585 -0.1495 0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4269 -0.9996 -0.2056 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0033 0.0286 -1.2723 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4406 1.0349 -0.1909 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3746 0.1491 0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8378 -1.0650 0.5697 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2247 1.9172 1.1075 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2672 -0.5066 1.0224 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8090 -1.9062 -0.5917 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8254 -0.3190 -1.8751 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8994 0.3503 -1.7896 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8176 1.9484 -0.5583 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3177 0.4139 1.0077 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1915 -1.9713 1.0331 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