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
-0.6366 -0.4763 1.2391 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2274 -0.8354 0.1039 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5174 -0.1090 -1.0055 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2620 1.2150 -0.2629 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4315 0.4874 0.9094 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4481 -0.2640 0.1286 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8680 -0.6402 -1.0195 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8502 -0.7927 2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0641 -1.5242 0.0079 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0317 -0.0252 -1.9209 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4701 1.8343 -0.7665 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1873 1.6892 0.0428 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7825 1.1262 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4477 -0.4560 0.4432 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3288 -1.2290 -1.8185 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