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
-0.6210 0.0205 1.3415 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3260 0.5791 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5711 0.3337 -0.8897 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1080 -1.1115 -0.6056 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5337 -0.6910 0.7273 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4433 0.3747 0.1667 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7268 1.0171 -0.7546 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8309 0.0618 2.4135 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2440 1.0977 0.4528 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0997 0.4475 -1.8005 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6211 -1.4567 -1.3288 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0008 -1.7085 -0.4692 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9946 -1.4586 1.2776 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4586 0.6048 0.4236 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0233 1.8894 -1.3186 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