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
-0.8886 1.0853 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2882 -0.1586 -0.7391 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3595 -1.0611 -0.0469 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1361 -0.2287 1.2368 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3074 0.9970 0.4155 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3817 0.3629 -0.3892 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0287 -0.9008 -0.6183 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3549 1.9978 -0.8753 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1368 -0.4353 -1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6616 -2.0613 0.1326 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0615 -0.0537 1.7731 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6846 -0.6732 1.7896 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5445 1.8573 0.9771 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2849 0.8944 -0.7088 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6554 -1.6220 -1.1191 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