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
0.8116 1.2365 0.2079 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2384 0.3723 -0.6997 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4026 -0.8582 -0.5998 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1683 -0.8541 0.9265 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3433 0.6002 0.8875 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3912 0.4311 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9567 -0.4834 -1.0394 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1912 2.2115 0.4419 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0427 0.4881 -1.4089 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8205 -1.7551 -0.9781 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6441 -1.5181 1.2088 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0953 -0.9431 1.4813 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6495 0.9913 1.8147 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3230 0.9669 -0.1829 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4628 -0.8859 -1.8968 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