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
0.7761 -1.0258 0.7073 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4310 0.1104 0.4452 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4977 0.9262 -0.3729 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0913 -0.1938 -1.2572 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5166 -1.0091 -0.0202 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3534 0.0363 0.6363 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6923 1.1810 0.4817 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1995 -1.7901 1.3636 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4163 0.3948 0.7482 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8997 1.7445 -0.9057 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9683 0.1655 -1.8183 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6709 -0.6963 -1.8397 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9767 -1.9338 -0.2317 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3029 -0.0350 1.1488 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9897 2.1251 0.9145 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