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
-1.2014 0.9075 -0.2009 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2541 -0.3265 -0.7004 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0895 -1.1040 -0.1668 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0598 -0.4068 1.1997 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0768 0.9841 0.5304 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2015 0.7090 -0.4364 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1169 -0.5705 -0.8356 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9141 1.7136 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0024 -0.7150 -1.3758 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2069 -2.1509 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0407 -0.5698 1.6383 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8018 -0.5484 1.8348 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2303 1.7906 1.1938 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9677 1.4017 -0.7757 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7766 -1.1146 -1.5013 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