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
1.3261 0.4760 0.5177 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2143 -0.8131 0.1479 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0934 -0.9883 -0.5352 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2199 0.4059 -1.1832 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0206 1.1049 0.1714 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0073 0.4177 0.9758 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1449 -0.8216 0.5104 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1611 0.9917 0.9717 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9783 -1.5721 0.3365 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1969 -1.8002 -1.2002 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6010 0.5909 -1.8822 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2223 0.5900 -1.5574 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0047 2.1634 0.1288 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5547 0.8457 1.8007 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8572 -1.5910 0.7973 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