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
1.1966 0.0197 0.9113 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0452 0.4816 1.3989 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0266 0.2010 0.4038 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4990 -1.1603 -0.1037 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8876 -0.5544 -0.4114 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4317 0.6006 -1.2703 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7601 0.9975 -0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1824 0.0373 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1157 0.9767 2.3452 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0211 0.1798 0.7576 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0148 -1.4707 -1.0112 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4535 -1.8903 0.6997 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5761 -1.2167 -0.8543 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9489 1.0561 -2.1066 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3777 1.7421 -1.2859 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