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
0.7136 -1.0797 -0.7085 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3502 0.0846 -0.6651 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5090 0.9754 0.1716 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1135 -0.0471 1.2602 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4823 -1.0044 0.2078 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4359 -0.0676 -0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8227 1.1131 -0.4703 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9513 -1.9692 -1.2762 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2786 0.3573 -1.1264 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9588 1.8566 0.5464 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0128 -0.4481 1.7153 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6462 0.3476 1.9297 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8489 -1.9162 0.5791 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4254 -0.2229 -0.8319 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2264 2.0206 -0.8910 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