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
-0.8859 -0.6578 0.9519 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2691 0.5565 0.5595 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2776 0.9677 -0.4757 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1507 -0.3829 -1.2116 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2692 -1.0949 0.0907 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4058 -0.2198 0.4673 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0252 1.0267 0.2102 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2904 -1.2711 1.7394 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1222 1.0947 0.9355 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5502 1.7786 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1340 -0.7163 -1.5488 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6414 -0.3716 -1.9474 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4340 -2.1276 0.0098 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3523 -0.5199 0.8683 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5519 1.9377 0.4479 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