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
-0.1377 -1.3704 -0.5773 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0091 -0.4529 -0.9686 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8093 0.7736 -0.1239 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4366 0.0605 1.1946 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6572 -0.7761 0.4932 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4082 0.3724 -0.1297 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5263 1.3060 -0.4687 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0452 -2.3538 -0.9776 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7530 -0.5344 -1.7571 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6188 1.4402 -0.0582 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0166 0.7807 1.8864 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2318 -0.5769 1.5537 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2166 -1.3956 1.1364 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4706 0.4704 -0.2947 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7791 2.2563 -0.9085 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