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
-0.6524 -0.1454 1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1659 0.7880 0.4973 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4136 0.6566 -0.8065 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3533 -0.8829 -0.8489 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3331 -0.9415 0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4718 -0.0137 0.2493 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9824 0.9712 -0.4994 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9199 -0.2886 2.3284 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9321 1.5180 0.6327 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8742 1.1062 -1.6432 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2808 -1.2535 -1.6394 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3296 -1.3375 -0.7257 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5726 -1.9076 0.8719 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5023 -0.1239 0.5896 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4979 1.8547 -0.8351 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